SCHEMBL31251508

SCHEMBL31251508

N#Cc1nnc2c(Cl)cc(Br)cc2c1Cl

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ POLB P06746 1/20 0.31

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
SCHEMBL31251452 0.74 EGFR (0.34) —
SCHEMBL23899093 0.72 SRC (0.37) ALDH1A1
SCHEMBL6820309 0.70 ENPP1 (0.42) KDM4EALDH1A1POLB
SCHEMBL31251374 0.68 CASP1 (0.33) —
SCHEMBL23899063 0.64 SRC (0.36) —
SCHEMBL1630093 0.63 ALDH1A1 (0.44) KDM4EALDH1A1POLB
SCHEMBL1630139 0.63 NMT1 (0.38) KDM4EALDH1A1
SCHEMBL1579589 0.62 SRC (0.37) —
SCHEMBL31251462 0.61 DHODH (0.37) KDM4EALDH1A1
SCHEMBL29206164 0.61 TDP1 (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
WO-2024245157-A1 AZAQUINOLINE RING DERIVATIVE 浙江星浩澎博医药有限公司 2024-12-05 — — WO disclosed
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