SCHEMBL30970570

SCHEMBL30970570

C=Cc1c(=O)[nH]cc2cncnc12

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AURKA O14965 1/20 0.32
TTK P33981 1/20 0.32
AURKB Q96GD4 1/20 0.32
INCENP Q9NQS7 1/20 0.32

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
SCHEMBL30812401 0.75 AURKA (0.34) AURKATTKAURKBINCENP
SCHEMBL30970559 0.73 AURKA (0.31) AURKATTKAURKBINCENP
SCHEMBL30970590 0.71 EGFR (0.35) AURKATTKAURKBINCENP
SCHEMBL15212500 0.71 DPYD (0.40) AURKATTKAURKBINCENP
SCHEMBL30970585 0.71 PIK3CD (0.33) AURKATTKAURKBINCENP
SCHEMBL30970557 0.71 AURKA (0.32) AURKATTKAURKBINCENP
SCHEMBL30970555 0.67 CSNK2A1 (0.38)
SCHEMBL30970589 0.66 ADRB2 (0.40)
SCHEMBL30970593 0.65 LRRK2 (0.37)
SCHEMBL30970612 0.65 POLB (0.36)

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-117957226-A Heterocyclic compounds as SOS1 inhibitors and uses thereof 南京再明医药有限公司 2024-04-30 CN disclosed