SCHEMBL28903759

SCHEMBL28903759

COc1cccc(F)c1-c1cc(-c2ccc(N3CCN(C)CC3)cc2)n[nH]1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 11/20 0.64
MELK Q14680 1/20 0.60
PRKD1 Q15139 7/20 0.50
LCK P06239 1/20 0.47
MAP4K3 Q8IVH8 1/20 0.47
FGFR1 P11362 1/20 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
SCHEMBL28977171 0.92 MAP4K1 (0.66) MAP4K1MELKPRKD1LCKMAP4K3
SCHEMBL28903809 0.90 MELK (0.70) MAP4K1MELKPRKD1
SCHEMBL28903830 0.90 MAP4K1 (0.52) MAP4K1MELKPRKD1FGFR1
SCHEMBL28960285 0.89 MELK (0.57) MAP4K1MELKPRKD1
SCHEMBL28960287 0.88 MELK (0.60) MAP4K1MELKPRKD1LCKMAP4K3
SCHEMBL19951647 0.88 MELK (0.57) MAP4K1MELKPRKD1LCKMAP4K3
SCHEMBL28903756 0.86 MELK (0.64) MAP4K1MELKPRKD1
SCHEMBL19951714 0.86 MAP4K1 (0.48) MAP4K1MELKFGFR1
SCHEMBL28903817 0.85 MELK (0.63) MAP4K1MELKPRKD1
SCHEMBL19951736 0.84 MAP4K1 (0.54) MAP4K1MELK

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
CN-115819417-A Pyrazolopyridine derivatives as HPK1 modulators and their use for the treatment of cancer 因赛特公司 2023-03-21 CN disclosed
CN-109923114-B Pyrazolopyridine derivatives as HPK1 modulators and their use for the treatment of cancer 因赛特公司 2022-11-01 CN disclosed