SCHEMBL29448714

SCHEMBL29448714

COc1ccc(Nc2ncccc2-c2ncnc3[nH]cnc23)cc1NC(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.81

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 19/20 0.81
▸ BRAF P15056 1/20 0.60
▸ POLB P06746 1/20 0.54

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
SCHEMBL19233275 1.00 KDR (0.81) KDRBRAFPOLB
SCHEMBL19233210 0.95 KDR (0.81) KDRBRAF
SCHEMBL19233419 0.94 KDR (0.81) KDRBRAF
SCHEMBL29448729 0.90 KDR (0.81) KDRBRAF
SCHEMBL19233546 0.90 KDR (0.81) KDRBRAF
SCHEMBL29448682 0.89 KDR (0.80) KDR
SCHEMBL19233198 0.89 KDR (0.80) KDR
SCHEMBL19233405 0.89 KDR (0.81) KDRBRAF
SCHEMBL29448728 0.89 KDR (0.81) KDRBRAF
SCHEMBL19233292 0.87 KDR (0.79) KDRBRAF

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-3412670-B1 PYRIDINE DERIVATIVES INHIBITING RAF KINASE AND VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR, PHARMACEUTICAL COMPOSITION CONTAINING THEM AND USE THEREOF SAMJIN PHARM CO LTD (KR) 2022-03-09 — — EP claimed
EP-3412670-B1 PYRIDINE DERIVATIVES INHIBITING RAF KINASE AND VASCULAR ENDOTHELIAL GROWTH FACTOR RECEPTOR, PHARMACEUTICAL COMPOSITION CONTAINING THEM AND USE THEREOF SAMJIN PHARM CO LTD (KR) 2022-03-09 — — EP disclosed
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