SCHEMBL31551268

SCHEMBL31551268

COC(=O)CN(C(=O)C[C@@H]1CCC(=O)N1Cc1cccc(F)c1F)[C@H](C(=O)OC)C(C)C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 14/20 0.42
▸ GPR119 Q8TDV5 1/20 0.33
▸ CYP2D6 P10635 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ CYP2C19 P33261 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
SCHEMBL31551328 0.94 P2RX7 (0.41) P2RX7GPR119
SCHEMBL31551243 0.92 P2RX7 (0.46) P2RX7GPR119
SCHEMBL31551261 0.89 P2RX7 (0.41) P2RX7GPR119CYP2D6CYP2C9CYP2C19
SCHEMBL31551229 0.89 P2RX7 (0.41) P2RX7GPR119CYP2D6CYP2C9CYP2C19
SCHEMBL31551638 0.89 P2RX7 (0.41) P2RX7GPR119CYP2D6CYP2C9CYP2C19
SCHEMBL31551350 0.88 RIPK1 (0.33) P2RX7
SCHEMBL31551175 0.88 P2RX7 (0.45) P2RX7GPR119CYP2D6CYP2C9CYP2C19
SCHEMBL31551530 0.88 P2RX7 (0.42) P2RX7GPR119CYP2D6CYP2C9CYP2C19
SCHEMBL31551411 0.85 P2RX7 (0.44) P2RX7GPR119
SCHEMBL31551430 0.84 P2RX7 (0.43) P2RX7

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-2025080861-A1 5-MEMBERED RING-BASED MOLECULES AND THEIR USE AS HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2025-04-17 — — WO disclosed
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