SCHEMBL31344557

SCHEMBL31344557

CP(C)(=O)c1ccccc1Nc1nc(Nc2ccc3c(c2)OCCO3)nc2[nH]ccc12

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 20/20 0.66

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
SCHEMBL29746980 0.81 PTK2 (0.61) PTK2
SCHEMBL20776856 0.81 PTK2 (0.69) PTK2
SCHEMBL31229866 0.79 PTK2 (0.63) PTK2
SCHEMBL31229708 0.79 PTK2 (0.61) PTK2
SCHEMBL31229860 0.79 PTK2 (0.61) PTK2
SCHEMBL31229649 0.79 PTK2 (0.63) PTK2
SCHEMBL31229639 0.79 PTK2 (0.61) PTK2
SCHEMBL31229790 0.79 PTK2 (0.61) PTK2
SCHEMBL29746795 0.79 PTK2 (0.63) PTK2
SCHEMBL31344567 0.79 PTK2 (0.63) PTK2

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
WO-2024240118-A1 PREPARATION FOR AND USE OF HETEROARYL DERIVATIVES 广州智睿医药科技有限公司 2024-11-28 — — WO claimed
WO-2024240118-A1 PREPARATION FOR AND USE OF HETEROARYL DERIVATIVES 广州智睿医药科技有限公司 2024-11-28 — — WO disclosed
Send feedback