SCHEMBL15076046

SCHEMBL15076046

NCCCCCNC(=O)CCCCCS

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A5 Q9Y345 2/20 0.58
PAOX Q6QHF9 2/20 0.50
HDAC3 O15379 7/20 0.49
HDAC1 Q13547 7/20 0.49
HDAC2 Q92769 7/20 0.49
HDAC10 Q969S8 7/20 0.49
HDAC11 Q96DB2 7/20 0.49
HDAC8 Q9BY41 7/20 0.49
HDAC6 Q9UBN7 7/20 0.49
HDAC4 P56524 6/20 0.49
HDAC7 Q8WUI4 6/20 0.49
HDAC9 Q9UKV0 6/20 0.49
HDAC5 Q9UQL6 6/20 0.49
KDM4A O75164 1/20 0.47
HIF1A Q16665 1/20 0.47
TET2 Q6N021 1/20 0.47
DOHH Q9BU89 1/20 0.47
DNM1 Q05193 1/20 0.45
CASP2 P42575 1/20 0.44
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL15452325 1.00 SLC6A5 (0.58) SLC6A5PAOXHDAC3HDAC1HDAC2
SCHEMBL9128874 0.94 SLC6A5 (0.51) SLC6A5PAOXHDAC3HDAC1HDAC2
SCHEMBL7209833 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7203302 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7208464 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7215984 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL7215946 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL12863577 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL17373920 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2
SCHEMBL8995394 0.90 SLC6A5 (0.67) SLC6A5PAOXKDM4AHIF1ATET2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3883926-B1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDE DERIVATIVES AND PROTEIN CONJUGATES THEREOF FOR USE AS LXR AGONISTS REGENERON PHARMA (US) 2024-07-10 EP disclosed
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF FIREFLY BIO, INC. 2024-07-04 US disclosed
US-11786603-B2 Optimized transglutaminase site-specific antibody conjugation REGENERON PHARMACEUTICALS, INC. (US) 2023-10-17 US disclosed
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2023-09-14 US disclosed
WO-2023129518-A1 TUBULYSINS AND PROTEIN-TUBULYSIN CONJUGATES REGENERON PHARMACEUTICALS, INC. (US) 2023-07-06 WO disclosed
US-11666658-B2 Rifamycin analogs and antibody-drug conjugates thereof Regeneran Pharmaceuticals, Inc. (US) 2023-06-06 US disclosed
US-11666658-B2 Rifamycin analogs and antibody-drug conjugates thereof Regeneran Pharmaceuticals, Inc. (US) 2023-06-06 US disclosed
US-20230035898-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES REGENERON PHARMACEUTICALS, INC. 2023-02-02 US disclosed
US-11377502-B2 Anti-MSR1 antibodies and methods of use thereof REGENERON PHARMACEUTICALS, INC. (US) 2022-07-05 US disclosed
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. 2022-04-14 US disclosed
US-20150165064-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES ARARIS BIOTECH LTD (CH) 2015-06-18 US disclosed
WO-2014202775-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES INNATE PHARMA (FR) 2014-12-24 WO disclosed
US-20140356385-A1 ENZYMATIC CONJUGATION OF ANTIBODIES ARARIS BIOTECH LTD (CH) 2014-12-04 US disclosed
US-20140356385-A1 ENZYMATIC CONJUGATION OF ANTIBODIES ARARIS BIOTECH LTD (CH) 2014-12-04 US disclosed
WO-2014140300-A1 SOLID PHASE TGASE-MEDIATED CONJUGATION OF ANTIBODIES INNATE PHARMA (FR) 2014-09-18 WO disclosed
WO-2014072482-A1 RECOGNITION TAGS FOR TGASE-MEDIATED CONJUGATION INNATE PHARMA (FR) 2014-05-15 WO disclosed
US-20130189287-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES PAUL SCHERRER INSTITUT 2013-07-25 US disclosed
US-20130189287-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES PAUL SCHERRER INSTITUT 2013-07-25 US disclosed
WO-2013092998-A1 ENZYMATIC CONJUGATION OF ANTIBODIES INNATE PHARMA (FR) 2013-06-27 WO disclosed
WO-2013092983-A2 ENZYMATIC CONJUGATION OF POLYPEPTIDES INNATE PHARMA (FR) 2013-06-27 WO 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 (10 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-20130189287-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES DNPEP, ENPEP, PEPD SLC6A5 4062/4885PAOX 899/4885HDAC3 2362/4885
US-20240218011-A1 GLUCOCORTICOID RECEPTOR AGONISTS AND CONJUGATES THEREOF NR3C1, NR3C2, MC2R SLC6A5 4503/4885PAOX 728/4885HDAC3 1371/4885
US-20220112158-A1 BIS-OCTAHYDROPHENANTHRENE CARBOXAMIDES AND PROTEIN CONJUGATES THEREOF NR1H4, NR1H3, OGFR SLC6A5 4391/4885PAOX 475/4885HDAC3 297/4885
US-20140356385-A1 ENZYMATIC CONJUGATION OF ANTIBODIES DNPEP, MPO, FCGR3B SLC6A5 3795/4885PAOX 876/4885HDAC3 1271/4885
US-11666658-B2 Rifamycin analogs and antibody-drug conjugates thereof ASGR1, CUTA, SRPRA SLC6A5 3395/4885PAOX 3585/4885HDAC3 3355/4885
US-11786603-B2 Optimized transglutaminase site-specific antibody conjugation TGM2, TGM3, TGM1 SLC6A5 723/4885PAOX 2510/4885HDAC3 3157/4885
US-20230035898-A1 CYCLODEXTRIN PROTEIN DRUG CONJUGATES SDCBP, DDOST, KRTCAP2 SLC6A5 4491/4885PAOX 3268/4885HDAC3 2066/4885
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF ASGR1, CUTA, SRPRA SLC6A5 3395/4885PAOX 3585/4885HDAC3 3355/4885
US-11377502-B2 Anti-MSR1 antibodies and methods of use thereof CD47, MSR1, LDLR SLC6A5 3851/4885PAOX 4125/4885HDAC3 1779/4885
US-20150165064-A1 ENZYMATIC CONJUGATION OF POLYPEPTIDES DNPEP, ENPEP, PEPD SLC6A5 4077/4885PAOX 814/4885HDAC3 2319/4885

“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.