SCHEMBL31489678

SCHEMBL31489678

Cc1c(-c2cncc(-c3cnn([C@H](c4ccc(F)cc4)C(C)(F)F)c3)n2)ccc2nc(N)nn12

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GLA P06280 1/20 0.31
GAA P10253 1/20 0.31
PKM P14618 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
SCHEMBL31489257 0.89
SCHEMBL31489551 0.87
SCHEMBL31489641 0.86 KDM4E (0.32) KDM4EALDH1A1GLAGAAPKM
SCHEMBL31489576 0.84 PIK3CD (0.41) KDM4EALDH1A1GLAGAAPKM
SCHEMBL31489839 0.83 PIK3CG (0.43)
SCHEMBL31489864 0.83 PIK3CG (0.37)
SCHEMBL31489610 0.83 PIK3CG (0.43)
SCHEMBL31489252 0.81 PIK3CG (0.43)
SCHEMBL31489624 0.81 PIK3CG (0.43)
SCHEMBL31489461 0.79 PIK3CD (0.32)

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-2025072395-A1 TRIAZOLOPYRIDINYL COMPOUNDS AS KINASE INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2025-04-03 WO disclosed