SCHEMBL30791246

SCHEMBL30791246

Nc1n[nH]c2nc(Nc3c(O)ccc4c3CCC4)c(F)cc12

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ SOS1 Q07889 1/20 0.32

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
SCHEMBL23356052 1.00 SOS1 (0.32) SOS1
SCHEMBL23356085 0.86 NLRP3 (0.37) SOS1
SCHEMBL30791249 0.84 NPC1 (0.33) —
SCHEMBL23356079 0.84 NPC1 (0.33) —
SCHEMBL30791200 0.80 EGFR (0.46) —
SCHEMBL23356028 0.80 EGFR (0.46) —
SCHEMBL30791299 0.79 — —
SCHEMBL23356077 0.79 — —
SCHEMBL23356064 0.78 EGFR (0.46) —
SCHEMBL30791250 0.78 EGFR (0.46) —

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-112313232-B Novel heterocyclic derivatives JW中外制药公司 2024-03-08 — — CN disclosed
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