SCHEMBL31115519

SCHEMBL31115519

Cc1nc(Cl)c(N)c(N[C@H](C)c2cccc(C(F)F)c2F)n1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 20/20 0.50
KRAS P01116 17/20 0.50

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
SCHEMBL25428064 0.82 SOS1 (0.48) SOS1KRAS
SCHEMBL29755186 0.82 SOS1 (0.48) SOS1KRAS
SCHEMBL29755178 0.82 SOS1 (0.48) SOS1KRAS
SCHEMBL30148551 0.79 KRAS (0.60) SOS1KRAS
SCHEMBL31115637 0.79 KRAS (0.60) SOS1KRAS
SCHEMBL25101064 0.79 SOS1 (0.48) SOS1KRAS
SCHEMBL25100872 0.79 SOS1 (0.48) SOS1KRAS
SCHEMBL24096429 0.79 SOS1 (0.47) SOS1KRAS
SCHEMBL29755140 0.79 SOS1 (0.49) SOS1KRAS
SCHEMBL29755458 0.79 SOS1 (0.49) 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
CN-115697994-B Fused quinazoline derivative, preparation method thereof and application thereof in medicine 江苏恒瑞医药股份有限公司 2024-08-13 CN disclosed