SCHEMBL14200596

SCHEMBL14200596

CC(C)OCCNCCO

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
CYP1A2 P05177 1/20 0.38
POLB P06746 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 7/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 2/20 0.34
ALOX15 P16050 1/20 0.34
EPHX2 P34913 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAPK1 P28482 1/20 0.32

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
SCHEMBL1967441 0.87 ALDH1A1 (0.38) TSHRL3MBTL1ALDH1A1LMNAEPHX2
SCHEMBL11474804 0.86 ALDH1A1 (0.47) TSHRL3MBTL1CYP1A2CYP2D6CYP2C19
SCHEMBL17664965 0.79 LMNA (0.48) TSHRL3MBTL1CYP1A2POLBCYP2D6
SCHEMBL24914369 0.78 L3MBTL1 (0.40) TSHRL3MBTL1POLBALDH1A1EPHX2
SCHEMBL26575886 0.78
SCHEMBL9288942 0.78 HTR1B (0.34) TSHRL3MBTL1ALDH1A1EPHX2SMN1; SMN2
SCHEMBL18500437 0.77 TSHR (0.36) TSHRL3MBTL1CYP1A2POLBCYP2D6
SCHEMBL19227373 0.77 TSHR (0.33) TSHRL3MBTL1CYP1A2POLBCYP2D6
SCHEMBL13572982 0.76 CA12 (0.48) TSHRL3MBTL1CYP1A2CYP2C19ALDH1A1
SCHEMBL22702567 0.76 ALDH1A1 (0.32) TSHRL3MBTL1ALDH1A1EPHX2SMN1; SMN2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023177356-A2 COMPOUNDS AND METHOD FOR PKMYT1 INHIBITION ENGINE BIOSCIENCES PTE. LTD. (SG) 2023-09-21 WO disclosed
US-20210139897-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS SAREPTA THERAPEUTICS, INC. 2021-05-13 US disclosed
US-8778874-B2 Glycopeptide antibiotic monomer derivatives NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-07-15 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 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 (2 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-20210139897-A1 OLIGONUCLEOTIDE ANALOGUES HAVING MODIFIED INTERSUBUNIT LINKAGES AND/OR TERMINAL GROUPS NSUN2, UPF1, RTCB TSHR 2993/4885L3MBTL1 15/4885CYP1A2 4698/4885
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 TSHR 508/4885L3MBTL1 3585/4885CYP1A2 847/4885

“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.