SCHEMBL18155032

SCHEMBL18155032

O=c1[nH]cc(-c2ccc(CO)cc2)cc1-c1nc2cc(N3CCNCC3)ccc2[nH]1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TGFB2 P61812 1/20 0.72
PIM1 P11309 8/20 0.40
PIM3 Q86V86 8/20 0.40
ACVR1 Q04771 2/20 0.39
BMPR1B O00238 1/20 0.39
BMPR1A P36894 1/20 0.39
ACVRL1 P37023 1/20 0.39
PIM2 Q9P1W9 5/20 0.38
SYK P43405 1/20 0.37
PARP1 P09874 2/20 0.37
CDC7 O00311 1/20 0.36
PRMT5 O14744 1/20 0.35
MET P08581 1/20 0.35
FLT3 P36888 2/20 0.35
KIT P10721 1/20 0.35
KDR P35968 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
SCHEMBL18155029 0.91 TGFB2 (0.87) TGFB2PIM1PIM3PIM2PARP1
Hydrochloric Acid SCHEMBL18155058 0.90 TGFB2 (0.85) TGFB2PIM1PIM3PIM2PARP1
SCHEMBL18163900 0.90 TGFB2 (0.59) TGFB2ACVR1ACVRL1PARP1MET
SCHEMBL18155047 0.89 TGFB2 (0.65) TGFB2PIM1PIM3ACVR1BMPR1B
Hydrochloric Acid SCHEMBL18155096 0.89 TGFB2 (0.64) TGFB2PIM1PIM3ACVR1BMPR1B
SCHEMBL18155108 0.88 TGFB2 (0.81) TGFB2PIM1PIM3PIM2PARP1
SCHEMBL18155053 0.87 TGFB2 (0.64) TGFB2PIM1PIM3ACVR1PIM2
SCHEMBL18155060 0.87 TGFB2 (0.64) TGFB2PIM1PIM3ACVR1PIM2
SCHEMBL18155083 0.86 TGFB2 (0.64) TGFB2PIM1PIM3ACVR1PIM2
SCHEMBL18155087 0.84 TGFB2 (0.61) TGFB2PIM1PIM3PIM2PARP1

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-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
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 267/4885PIM1 68/4885PIM3 140/4885
US-20180099947-A1 3-(1H-BENZIMIDAZOL-2-YL)-1H-PYRIDIN-2-ONE DERIVATIVES ALK, ABL2, ACVR1 TGFB2 267/4885PIM1 68/4885PIM3 140/4885

“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.