SCHEMBL3576164

SCHEMBL3576164

NC(=O)c1ccc(C(N)=O)[nH]1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 1/20 0.46
MKNK1 Q9BUB5 1/20 0.40
PARP1 P09874 2/20 0.39
BLM P54132 2/20 0.39
MAPT P10636 2/20 0.39
TSHR P16473 2/20 0.39
HSD17B10 Q99714 2/20 0.39
POLB P06746 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
PMP22 Q01453 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CCNC P24863 3/20 0.38
CDK8 P49336 3/20 0.38
PARP10 Q53GL7 3/20 0.37
PARP4 Q9UKK3 2/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 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
SCHEMBL29063211 0.82
SCHEMBL279430 0.82
SCHEMBL15014049 0.82 SMN1; SMN2 (0.35) MAP2K1MKNK1PARP1MAPTPOLB
SCHEMBL30846960 0.82 PTPN11 (0.41) MAP2K1MKNK1TSHRCCNCCDK8
SCHEMBL1040616 0.78 MAP2K1 (0.36) MAP2K1MKNK1PARP1BLMMAPT
SCHEMBL21776597 0.78 KDM4E (0.53) MAP2K1MKNK1PARP1MAPTTSHR
SCHEMBL9386247 0.78 MKNK1 (0.43) MAP2K1MKNK1MAPTTSHRHSD17B10
SCHEMBL17362824 0.77 MKNK1 (0.42) MAP2K1MKNK1PARP1MAPTPOLB
SCHEMBL31502297 0.77 KDM4E (0.43) MAP2K1MKNK1HSD17B10TDP1CCNC
SCHEMBL13430799 0.77 NNMT (0.39) MAP2K1MKNK1PARP1POLBCCNC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2014195705-A1 NOVEL PYRROLE DERIVATIVES UNIVERSITY OF LEICESTER (GB) 2014-12-11 WO claimed
EP-2076492-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS Merck & Co., Inc. (US) 2009-07-08 EP claimed
WO-2008054605-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2008-05-08 WO claimed
EP-4558224-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2025-05-28 EP disclosed
WO-2024018423-A1 PYRROLES AND IMIDAZOLES AS BET PROTEIN INHIBITORS Tay Therapeutics Limited (GB) 2024-01-25 WO disclosed
US-20220153732-A1 PROTEIN SECRETION INHIBITORS ENODIA THERAPEUTICS SAS (FR) 2022-05-19 US disclosed
WO-2014195705-A1 NOVEL PYRROLE DERIVATIVES UNIVERSITY OF LEICESTER (GB) 2014-12-11 WO disclosed
WO-2014195718-A1 3,4-DIHYDROXY-PYRROLE DERIVATIVES AS ANTIBACTERIAL AGENTS UNIVERSITY OF LEICESTER (GB) 2014-12-11 WO disclosed
US-20100113421-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK SHARP & DOHME CORP. 2010-05-06 US disclosed
EP-2076492-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS Merck & Co., Inc. (US) 2009-07-08 EP disclosed
WO-2008054605-A2 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS MERCK & CO., INC. (US) 2008-05-08 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 (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-20100113421-A1 NON-NUCLEOSIDE REVERSE TRANSCRIPTASE INHIBITORS RTF1, RNGTT, POLR2E MAP2K1 4190/4885MKNK1 3737/4885PARP1 549/4885
US-20220153732-A1 PROTEIN SECRETION INHIBITORS SEC61B, SEC61A1, SEC61G MAP2K1 3086/4885MKNK1 643/4885PARP1 4383/4885

“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.