SCHEMBL29755407

SCHEMBL29755407

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

nearest known ligand 0.48

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 20/20 0.48
KRAS P01116 2/20 0.40

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
SCHEMBL29755218 0.91 SOS1 (0.50) SOS1KRAS
SCHEMBL29755425 0.89 SOS1 (0.49) SOS1KRAS
SCHEMBL29755282 0.86 SOS1 (0.63) SOS1KRAS
SCHEMBL29755249 0.84 SOS1 (0.48) SOS1KRAS
SCHEMBL29755534 0.80 SOS1 (0.45) SOS1KRAS
SCHEMBL29849038 0.76 SOS1 (0.61) SOS1KRAS
SCHEMBL29824204 0.74 SOS1 (0.45) SOS1KRAS
SCHEMBL30014869 0.74 SOS1 (0.70) SOS1KRAS
SCHEMBL23520558 0.74 SOS1 (0.49) SOS1KRAS
SCHEMBL23521100 0.73 SOS1 (0.57) 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-2022156792-A1 HETEROCYCLIC COMPOUNDS AS SOS1 INHIBITORS GUANGDONG NEWOPP BIOPHARMACEUTICALS CO., LTD. (CN) 2022-07-28 WO disclosed