SCHEMBL409869

SCHEMBL409869

CC(C)(C)C(=O)C1c2ccccc2-c2ccccc21

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
HBB P68871 1/20 0.66
HSD17B10 Q99714 1/20 0.66
HDAC4 P56524 2/20 0.52
HDAC7 Q8WUI4 2/20 0.52
HDAC5 Q9UQL6 2/20 0.52
HDAC3 O15379 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
HDAC9 Q9UKV0 1/20 0.52
NCOR2 Q9Y618 1/20 0.52
POLB P06746 3/20 0.46
KMT2A Q03164 2/20 0.42
LMNA P02545 2/20 0.40
GPR3 P46089 1/20 0.39
MEN1 O00255 1/20 0.39
OPRK1 P41145 1/20 0.37
CYP1A2 P05177 1/20 0.37
TSHR P16473 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28485980 0.83 HBB (0.66) ALDH1A1HBBHSD17B10HDAC4HDAC7
SCHEMBL18993484 0.81 HDAC3 (0.46) ALDH1A1HBBHSD17B10HDAC4HDAC7
SCHEMBL21172113 0.81 HDAC3 (0.46) ALDH1A1HBBHSD17B10HDAC4HDAC7
SCHEMBL18748394 0.79 HDAC3 (0.52) ALDH1A1HBBHSD17B10HDAC4HDAC7
SCHEMBL435148 0.79 HBB (1.00) ALDH1A1HBBHSD17B10POLBKMT2A
SCHEMBL29729498 0.79 HBB (1.00) ALDH1A1HBBHSD17B10POLBKMT2A
SCHEMBL4388563 0.79 ATM (0.59) ALDH1A1HBBHSD17B10HDAC4HDAC7
SCHEMBL21236780 0.78 HDAC3 (0.43) ALDH1A1HBBHSD17B10HDAC4HDAC7
SCHEMBL27293815 0.78 HBB (0.96) ALDH1A1HBBHSD17B10POLBKMT2A
SCHEMBL9010860 0.76 HDAC3 (0.57) ALDH1A1HBBHSD17B10HDAC4HDAC7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11732259-B2 Peptide oligonucleotide conjugates SAREPTA THERAPEUTICS, INC. (US) 2023-08-22 US disclosed
US-11732259-B2 Peptide oligonucleotide conjugates SAREPTA THERAPEUTICS, INC. (US) 2023-08-22 US disclosed
US-20220127613-A1 Functionally-Modified Oligonucleotides And Subunits Thereof SAREPTA THERAPEUTICS INC (US) 2022-04-28 US disclosed
US-11225662-B2 Peptide oligonucleotide conjugates SAREPTA THERAPEUTICS, INC. (US) 2022-01-18 US disclosed
US-11208655-B2 Functionally-modified oligonucleotides and subunits thereof SAREPTA THERAPEUTICS, INC. (US) 2021-12-28 US disclosed
US-11072793-B2 DsRNA molecules comprising oligonucleotide analogs having modified intersubunit linkages and/or terminal groups SAREPTA THERAPEUTICS, INC. (US) 2021-07-27 US disclosed
US-20210139897-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS SAREPTA THERAPEUTICS, INC. 2021-05-13 US disclosed
US-20210139896-A1 Peptide Oligonucleotide Conjugates JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2021-05-13 US disclosed
US-20200277598-A1 Peptide Oligonucleotide Conjugates JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2020-09-03 US disclosed
US-10760078-B2 Oligonucleotide analogues having modified intersubunit linkages and/or terminal groups SAREPTA THERAPEUTICS, INC. (US) 2020-09-01 US disclosed
US-20140024821-A1 OLIGONUCLEOTIDE ANALOGUES TARGETING HUMAN LMNA SAREPTA THERAPEUTICS, INC. (US) 2014-01-23 US disclosed
US-20140024698-A1 METHODS FOR TREATING PROGEROID LAMINOPATHIES USING OLIGONUCLEOTIDE ANALOGUES TARGETING HUMAN LMNA SAREPTA THERAPEUTICS, INC. (US) 2014-01-23 US disclosed
US-20130288369-A1 dsRNA MOLECULES COMPRISING OLIGONUCLEOTIDE ANALOGS HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS SAREPTA THERAPEUTICS, INC. (US) 2013-10-31 US disclosed
US-20120289457-A1 PEPTIDE OLIGONUCLEOTIDE CONJUGATES AVI BIOPHARMA, INC. (US) 2012-11-15 US disclosed
US-20120065169-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS JPMORGAN CHASE BANK, N.A. AS ADMINISTRATIVE AGENT 2012-03-15 US disclosed
US-20120010361-A1 CURABLE COMPOSITION AND CURED PRODUCT THEREOF SHOWA DENKO K.K. (JP) 2012-01-12 US disclosed
US-20110294948-A1 AROMATIC GROUP-CONTAINING (METH) ACRYLATE COMPOUND SHOWA DENKO K.K. (JP) 2011-12-01 US disclosed
US-20110178066-A1 Hydroxypiperidine derivatives and uses thereof AVALON PHARMACEUTICALS 2011-07-21 US disclosed
US-20100249111-A1 MULTI-RING COMPOUNDS AND USES THEREOF AVALON PHARMACEUTICALS (US) 2010-09-30 US disclosed
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof AVALON PHARMACEUTICALS 2009-02-05 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (15 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120065169-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS NSUN2, UPF1, RTCB ALDH1A1 2803/4885HBB 1129/4885HSD17B10 2548/4885
US-20200277598-A1 Peptide Oligonucleotide Conjugates SNRPE, SMN1; SMN2, UPF1 ALDH1A1 3700/4885HBB 580/4885HSD17B10 2868/4885
US-11208655-B2 Functionally-modified oligonucleotides and subunits thereof RTCB, NSUN3, NSUN2 ALDH1A1 3163/4885HBB 670/4885HSD17B10 2840/4885
US-20110294948-A1 AROMATIC GROUP-CONTAINING (METH) ACRYLATE COMPOUND ACR, MMAB, ATR ALDH1A1 144/4885HBB 2214/4885HSD17B10 3045/4885
US-10760078-B2 Oligonucleotide analogues having modified intersubunit linkages and/or terminal groups NSUN2, UPF1, RTCB ALDH1A1 2803/4885HBB 1129/4885HSD17B10 2548/4885
US-20210139896-A1 Peptide Oligonucleotide Conjugates SNRPE, SMN1; SMN2, UPF1 ALDH1A1 3700/4885HBB 580/4885HSD17B10 2868/4885
US-20140024698-A1 METHODS FOR TREATING PROGEROID LAMINOPATHIES USING OLIGONUCLEOTIDE ANALOGUES TARGETING HUMAN LMNA LMNA, LMNB2, LMNB1 ALDH1A1 4254/4885HBB 248/4885HSD17B10 2196/4885
US-20100249111-A1 MULTI-RING COMPOUNDS AND USES THEREOF TP53, BCOR, HPGDS ALDH1A1 513/4885HBB 2999/4885HSD17B10 1571/4885
US-20210139897-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS NSUN2, UPF1, RTCB ALDH1A1 2803/4885HBB 1129/4885HSD17B10 2548/4885
US-20120289457-A1 PEPTIDE OLIGONUCLEOTIDE CONJUGATES SNRPE, SMN1; SMN2, UPF1 ALDH1A1 3700/4885HBB 580/4885HSD17B10 2868/4885
US-20220127613-A1 Functionally-Modified Oligonucleotides And Subunits Thereof RTCB, NSUN3, NSUN2 ALDH1A1 3163/4885HBB 670/4885HSD17B10 2840/4885
US-11225662-B2 Peptide oligonucleotide conjugates SNRPE, SMN1; SMN2, UPF1 ALDH1A1 3700/4885HBB 580/4885HSD17B10 2868/4885
US-20110178066-A1 Hydroxypiperidine derivatives and uses thereof HPGDS, HPGD, DPYD ALDH1A1 591/4885HBB 2691/4885HSD17B10 988/4885
US-20090036429-A1 Hydroxypiperidine Derivatives and Uses Thereof HPGDS, HPGD, DPYD ALDH1A1 591/4885HBB 2691/4885HSD17B10 988/4885
US-11732259-B2 Peptide oligonucleotide conjugates SNRPE, SMN1; SMN2, UPF1 ALDH1A1 3700/4885HBB 580/4885HSD17B10 2868/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.