SCHEMBL18155028

SCHEMBL18155028

O=c1[nH]cc(-c2ccnc3[nH]ccc23)cc1-c1nc2cc(N3CCCNCC3)ccc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TGFB2 P61812 1/20 0.49
ROCK2 O75116 4/20 0.46
ROCK1 Q13464 4/20 0.46
RHEB Q15382 1/20 0.43
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
PIM2 Q9P1W9 1/20 0.37
PRKCI P41743 6/20 0.37
PIK3C3 Q8NEB9 2/20 0.37
AURKA O14965 1/20 0.37
AURKB Q96GD4 1/20 0.37
INCENP Q9NQS7 1/20 0.37
TPX2 Q9ULW0 1/20 0.37
SYK P43405 1/20 0.36
IKBKB O14920 1/20 0.36
CHUK O15111 1/20 0.36
FLT3 P36888 1/20 0.35
CDC42BPB Q9Y5S2 1/20 0.35

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
SCHEMBL18155078 0.97 TGFB2 (0.52) TGFB2ROCK2ROCK1RHEBPIM1
SCHEMBL18155031 0.93 RHEB (0.46) TGFB2ROCK2ROCK1RHEBPRKCI
SCHEMBL18155086 0.88 ROCK2 (0.46) TGFB2ROCK2ROCK1RHEBSYK
SCHEMBL18155104 0.88 RHEB (0.45) TGFB2RHEBAURKAAURKBINCENP
SCHEMBL18164058 0.88 BMPR1B (0.45) TGFB2ROCK2ROCK1RHEBPRKCI
SCHEMBL18155039 0.87 RHEB (0.44) TGFB2ROCK2ROCK1RHEBPRKCI
SCHEMBL18155095 0.85 TGFB2 (0.51) TGFB2PIM1PIM3PIM2PIK3C3
SCHEMBL20048367 0.84 TGFB2 (0.55) TGFB2PIM1PIM3AURKAAURKB
SCHEMBL18164050 0.83 TGFB2 (0.58) TGFB2PIM1PIM3PIM2AURKA
SCHEMBL18163899 0.83 RHEB (0.43) TGFB2ROCK2ROCK1RHEBPRKCI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3283475-B1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2019-10-16 EP claimed
EP-3283475-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES Merck Patent GmbH (DE) 2018-02-21 EP claimed
WO-2016165808-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2016-10-20 WO claimed
EP-3283475-B1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2019-10-16 EP disclosed
US-10179777-B2 3-(1H-benzimidazol-2-yl)-1H-pyridin-2-one derivatives MERCK PATENT GMBH (DE) 2019-01-15 US disclosed
US-20180099947-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2018-04-12 US disclosed
EP-3283475-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES Merck Patent GmbH (DE) 2018-02-21 EP disclosed
WO-2016165808-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2016-10-20 WO disclosed
WO-2016165808-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES MERCK PATENT GMBH (DE) 2016-10-20 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 (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-10179777-B2 3-(1H-benzimidazol-2-yl)-1H-pyridin-2-one derivatives ALK, ABL2, ACVR1 TGFB2 267/4885ROCK2 556/4885ROCK1 578/4885
US-20180099947-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES ALK, ABL2, ACVR1 TGFB2 267/4885ROCK2 556/4885ROCK1 578/4885

“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.