SCHEMBL24671984

SCHEMBL24671984

Cc1nc(N[C@H](C)c2cc(N)cc(C(F)(F)F)c2)c2cc(C3(C(F)F)CC3)c(=O)[nH]c2n1

nearest known ligand 0.66

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 20/20 0.66
KRAS P01116 6/20 0.55

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
SCHEMBL23326449 0.83 SOS1 (0.69) SOS1KRAS
SCHEMBL23326450 0.83 SOS1 (0.69) SOS1KRAS
SCHEMBL23326632 0.79 SOS1 (1.00) SOS1KRAS
SCHEMBL23326636 0.79 SOS1 (1.00) SOS1KRAS
SCHEMBL29755282 0.79 SOS1 (0.63) SOS1KRAS
SCHEMBL29849386 0.78 SOS1 (0.75) SOS1KRAS
SCHEMBL24671932 0.78 SOS1 (0.75) SOS1KRAS
SCHEMBL25296369 0.77 SOS1 (0.77) SOS1KRAS
SCHEMBL23326445 0.77 SOS1 (1.00) SOS1KRAS
SCHEMBL23326442 0.77 SOS1 (1.00) SOS1KRAS

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-2022170802-A1 PYRIMIDO-PYRIDONE DERIVATIVE AS SOS1 INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州阿尔脉生物科技有限公司 2022-08-18 WO disclosed