SCHEMBL21322203

SCHEMBL21322203

C=CNCc1cccc(-c2ncc(OCC3CCN(C)CC3)cn2)c1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 5/20 0.53
▸ NQO2 P16083 1/20 0.53
▸ CXCR1 P25024 1/20 0.42
▸ APAF1 O14727 1/20 0.41
▸ CASP3 P42574 1/20 0.41
▸ SENP8 Q96LD8 1/20 0.41
▸ SENP7 Q9BQF6 1/20 0.41
▸ SENP6 Q9GZR1 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ HRH3 Q9Y5N1 1/20 0.40
▸ AKT1 P31749 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ KIT P10721 1/20 0.38
▸ ACHE P22303 2/20 0.37
▸ EGFR P00533 2/20 0.36
▸ AVPR1B P47901 1/20 0.36

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
SCHEMBL21322016 0.86 EP300 (0.47) METNQO2AKT1
SCHEMBL22309754 0.84 MET (0.58) METNQO2CXCR1APAF1CASP3
SCHEMBL31495087 0.83 MET (0.57) METNQO2CXCR1APAF1CASP3
SCHEMBL12547598 0.83 MET (0.57) METNQO2CXCR1APAF1CASP3
SCHEMBL1296276 0.83 MET (0.57) METNQO2CXCR1APAF1CASP3
SCHEMBL13449240 0.80 MET (0.53) METNQO2CXCR1HRH3ACHE
SCHEMBL31495102 0.80 MET (0.53) METNQO2CXCR1HRH3ACHE
SCHEMBL2223511 0.79 MET (0.52) METNQO2CXCR1HRH3EGFR
SCHEMBL23344107 0.76 MET (0.54) METNQO2CXCR1L3MBTL1HRH3
SCHEMBL26792863 0.75 MET (0.54) METNQO2CXCR1APAF1CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3533787-B1 PYRIDONE COMPOUND AS C-MET INHIBITOR FUJIAN COSUNTER PHARMACEUTICAL CO LTD (CN) 2020-09-30 — — EP disclosed
EP-3533787-A1 PYRIDONE COMPOUND AS C-MET INHIBITOR Fujian Cosunter Pharmaceutical Co., Ltd. (CN) 2019-09-04 — — EP disclosed
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