SCHEMBL18155047

SCHEMBL18155047

O=c1[nH]cc(-c2cc(CO)ccc2Cl)cc1-c1nc2cc(N3CCNCC3)ccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TGFB2 P61812 1/20 0.65
MET P08581 1/20 0.39
PTGES O14684 3/20 0.39
PRKAG1 P54619 1/20 0.37
PRKAA1 Q13131 1/20 0.37
PRKAB1 Q9Y478 1/20 0.37
ADRB1 P08588 1/20 0.36
PIM1 P11309 4/20 0.35
PIM3 Q86V86 4/20 0.35
PIM2 Q9P1W9 2/20 0.35
SIRT1 Q96EB6 1/20 0.34
SYK P43405 1/20 0.34
ACVR1 Q04771 2/20 0.34
BMPR1B O00238 1/20 0.34
BMPR1A P36894 1/20 0.34
ACVRL1 P37023 1/20 0.34
USP28 Q96RU2 1/20 0.33
PARP1 P09874 1/20 0.33
SUV39H2 Q9H5I1 1/20 0.33
CDC7 O00311 1/20 0.33

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
Hydrochloric Acid SCHEMBL18155096 0.99 TGFB2 (0.64) TGFB2METPTGESPRKAG1PRKAA1
SCHEMBL18155051 0.91 TGFB2 (0.55) TGFB2METPTGESPRKAG1PRKAA1
SCHEMBL18155032 0.89 TGFB2 (0.72) TGFB2METPIM1PIM3PIM2
SCHEMBL18155029 0.86 TGFB2 (0.87) TGFB2PIM1PIM3PIM2PARP1
Hydrochloric Acid SCHEMBL18155058 0.85 TGFB2 (0.85) TGFB2PIM1PIM3PIM2PARP1
SCHEMBL18155108 0.83 TGFB2 (0.81) TGFB2PIM1PIM3PIM2PARP1
SCHEMBL18155083 0.82 TGFB2 (0.64) TGFB2METPIM1PIM3PIM2
SCHEMBL18155059 0.81 TGFB2 (0.63) TGFB2METPRKAG1PRKAA1PIM1
SCHEMBL18155060 0.80 TGFB2 (0.64) TGFB2METPIM1PIM3PIM2
SCHEMBL18155053 0.80 TGFB2 (0.64) TGFB2METPIM1PIM3PIM2

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 7 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-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 267/4885MET 1112/4885PTGES 3933/4885
US-20180099947-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES ALK, ABL2, ACVR1 TGFB2 267/4885MET 1112/4885PTGES 3933/4885

“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.