SCHEMBL18155077

SCHEMBL18155077

CN1CCN(c2ccc3[nH]c(-c4cc(-c5cnn(C)c5)c[nH]c4=O)nc3c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 1/20 0.49
▸ TGFB2 P61812 1/20 0.47
▸ FGFR1 P11362 9/20 0.47
▸ PDGFRB P09619 7/20 0.47
▸ KDR P35968 7/20 0.47
▸ MET P08581 2/20 0.45
▸ AURKA O14965 1/20 0.44
▸ TTK P33981 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ INCENP Q9NQS7 1/20 0.44
▸ FLT1 P17948 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ TOP1 P11387 2/20 0.42
▸ TOP2A P11388 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.41
▸ MAPT P10636 1/20 0.41

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
SCHEMBL18155038 0.87 AURKA (0.52) BRD4TGFB2FGFR1PDGFRBKDR
SCHEMBL18164007 0.85 TGFB2 (0.52) TGFB2FGFR1PDGFRBKDRMET
SCHEMBL18163900 0.83 TGFB2 (0.59) BRD4TGFB2FGFR1PDGFRBKDR
SCHEMBL18163968 0.83 TGFB2 (0.44) TGFB2FGFR1PDGFRBKDRMET
SCHEMBL18164074 0.82 MET (0.46) BRD4TGFB2FGFR1PDGFRBKDR
SCHEMBL2680623 0.82 FYN (0.48) BRD4FGFR1PDGFRBKDRMET
SCHEMBL18164072 0.82 TGFB2 (0.71) BRD4TGFB2FGFR1PDGFRBKDR
SCHEMBL18155117 0.80 TGFB2 (0.53) BRD4TGFB2FGFR1PDGFRBKDR
SCHEMBL18155091 0.79 FGFR1 (0.50) TGFB2FGFR1PDGFRBKDRMET
SCHEMBL18155044 0.79 TGFB2 (0.67) BRD4TGFB2FGFR1PDGFRBKDR

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 8 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
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 BRD4 1969/4885TGFB2 267/4885FGFR1 26/4885
US-20180099947-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES ALK, ABL2, ACVR1 BRD4 1969/4885TGFB2 267/4885FGFR1 26/4885

“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.

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