SCHEMBL30943196

SCHEMBL30943196

COc1cc(-n2nc3cc(NC(=O)NCc4ccncc4)ccc3c2C#N)ccn1

nearest known ligand 0.46

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 17/20 0.45

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
SCHEMBL23320377 1.00 NAMPT (0.45) NAMPT
SCHEMBL23320353 0.84 NAMPT (0.60) NAMPT
SCHEMBL23320405 0.80 LRRK2 (0.37) —
SCHEMBL23320455 0.76 ROCK2 (0.50) NAMPT
SCHEMBL30943209 0.73 MDM4 (0.36) —
SCHEMBL23320355 0.73 MDM4 (0.36) —
SCHEMBL23320403 0.72 LRRK2 (0.31) —
SCHEMBL23320440 0.72 NAMPT (0.63) NAMPT
SCHEMBL23320390 0.70 CNR1 (0.41) —
SCHEMBL29232474 0.70 JAK2 (0.33) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112654608-B Fused ring compound having urea structure 桑福德伯纳姆普利斯医学发现研究所 2024-05-07 — — CN disclosed
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