SCHEMBL24671623

SCHEMBL24671623

C[C@@H](Nc1ncnc2c1cc(C1CCCN(C)C1)c(=O)n2C)c1cc(N)cc(C(F)(F)F)c1

nearest known ligand 0.76

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 20/20 0.76

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
SCHEMBL29849197 1.00 SOS1 (0.76) SOS1
SCHEMBL24671625 0.95 SOS1 (0.79) SOS1
SCHEMBL29849121 0.95 SOS1 (0.79) SOS1
SCHEMBL29849110 0.90 SOS1 (0.86) SOS1
SCHEMBL24671628 0.90 SOS1 (0.86) SOS1
SCHEMBL24671626 0.89 SOS1 (0.74) SOS1
SCHEMBL29849337 0.89 SOS1 (0.74) SOS1
SCHEMBL24671858 0.88 SOS1 (0.74) SOS1
SCHEMBL24671646 0.88 SOS1 (0.74) SOS1
SCHEMBL24671859 0.88 SOS1 (0.74) SOS1

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