SCHEMBL29907460

SCHEMBL29907460

C=CC(=O)N1C[C@@H]2C(=O)N(C)c3c(c4cc(F)c(-c5c(F)cccc5OC)nc4n(-c4c(C)cc(C)nc4C(C)C)c3=O)N2C[C@H]1C

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KRAS P01116 20/20 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
SCHEMBL27147442 1.00 KRAS (0.55) KRAS
SCHEMBL30725810 0.92 KRAS (0.60) KRAS
SCHEMBL29907500 0.90 KRAS (0.52) KRAS
SCHEMBL29907611 0.90 KRAS (0.43) KRAS
SCHEMBL27148647 0.90 KRAS (0.59) KRAS
SCHEMBL27151967 0.88 KRAS (0.53) KRAS
SCHEMBL27218584 0.87 KRAS (0.51) KRAS
SCHEMBL23300947 0.87 KRAS (0.58) KRAS
SCHEMBL30996229 0.87 KRAS (0.58) KRAS
SCHEMBL31129087 0.87 KRAS (0.58) KRAS

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
EP-4053118-A1 SUBSTITUTED HETEROCYCLIC FUSED CYCLIC COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF Genfleet Therapeutics (Shanghai) Inc. (CN) 2022-09-07 EP disclosed