SCHEMBL3340887

SCHEMBL3340887

NC(=O)c1cccc(-c2nc3ccccc3[nH]2)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.77
NPC1 O15118 4/20 0.77
RAB9A P51151 4/20 0.77
ALDH1A1 P00352 4/20 0.77
SMN1; SMN2 Q16637 3/20 0.77
HPGD P15428 3/20 0.77
CHEK2 O96017 7/20 0.68
MMP2 P08253 1/20 0.63
MMP9 P14780 1/20 0.63
COMT P21964 1/20 0.63
MMP8 P22894 1/20 0.63
MMP13 P45452 1/20 0.63
TP53 P04637 1/20 0.62
HSD17B10 Q99714 1/20 0.62
KMT2A Q03164 4/20 0.61
MEN1 O00255 3/20 0.61
POLB P06746 1/20 0.61
MAPT P10636 1/20 0.61
THRB P10828 1/20 0.61
RECQL P46063 1/20 0.61

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
SCHEMBL4714012 0.87 KDM4E (1.00) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL31679082 0.87 KDM4E (1.00) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL17672255 0.86 KDM4E (0.77) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
Terephthalamide SCHEMBL2641517 0.85 CHEK2 (0.76) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3663760 0.84 KDM4E (0.73) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL31472953 0.83 KDM4E (0.73) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL28591279 0.83 KDM4E (0.73) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL20797982 0.82 KDM4E (0.60) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL3335676 0.82 KDM4E (0.74) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL17705602 0.81 MMP2 (0.80) KDM4ENPC1RAB9AALDH1A1SMN1; 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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3672952-A1 BEZIMIDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS Merck Patent GmbH (DE) 2020-07-01 EP claimed
WO-2019038215-A1 BEZIMIDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2019-02-28 WO claimed
CN-115477615-B N- (3- (benzimidazol-2-yl) phenyl) amide compound and preparation method and application thereof 黄山学院 2024-06-18 CN disclosed
CN-115477615-A N- (3- (benzimidazole-2-yl) phenyl) amide compound and preparation method and application thereof 黄山学院 2022-12-16 CN disclosed
EP-3672952-A1 BEZIMIDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS Merck Patent GmbH (DE) 2020-07-01 EP disclosed
WO-2019038215-A1 BEZIMIDAZOLE DERIVATIVES AS ADENOSINE RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2019-02-28 WO disclosed
US-8642788-B2 Activators of executioner procaspases 3, 6 and 7 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-02-04 US disclosed
US-8198307-B2 Imidazole derivatives having aryl piperidine substituent, method for preparation thereof and pharmaceutical compositions containing same KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2012-06-12 US disclosed
EP-2237784-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 The Regents of the University of California (US) 2010-10-13 EP disclosed
US-20100145054-A1 IMIDAZOLE DERIVATIVES HAVING ARYL PIPERIDINE SUBSTITUENT, METHOD FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2010-06-10 US disclosed
WO-2009089508-A1 ACTIVATORS OF EXECUTIONER PROCASPASES 3, 6 AND 7 THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-07-16 WO disclosed
WO-2008140239-A1 IMIDAZOLE DERIVATIVES HAVING ARYL PIPERIDINE SUBSTITUENT, METHOD FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2008-11-20 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 (1 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-20100145054-A1 IMIDAZOLE DERIVATIVES HAVING ARYL PIPERIDINE SUBSTITUENT, METHOD FOR PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME TYR, MCHR1, MCHR2 KDM4E 220/4885NPC1 223/4885RAB9A 687/4885

“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.