SCHEMBL30699447

SCHEMBL30699447

F/C=C1\CN2CCC[C@@]2(COc2ncc3cc(F)cc(F)c3n2)C1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ KRAS P01116 20/20 0.34

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
SCHEMBL30706745 0.88 KRAS (0.33) KRAS
SCHEMBL29936919 0.78 KRAS (0.46) KRAS
Hydrochloric Acid SCHEMBL30699364 0.77 KRAS (0.46) KRAS
SCHEMBL30391380 0.72 KRAS (0.42) KRAS
SCHEMBL30706774 0.71 KRAS (0.41) KRAS
SCHEMBL30706980 0.71 KRAS (0.41) KRAS
SCHEMBL25336421 0.70 KRAS (0.39) KRAS
SCHEMBL26288684 0.69 — —
SCHEMBL24272822 0.69 — —
SCHEMBL27269373 0.69 — —

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-2023244713-A1 QUINAZOLINE DERIVATIVES, COMPOSITIONS AND METHODS THEREOF ENSEM THERAPEUTICS, INC. (US) 2023-12-21 — — WO disclosed
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