SCHEMBL31705155

SCHEMBL31705155

O=C(C[C@@H]1CCC(=O)N1Cc1cc(F)ccc1Cl)N[C@@H](CC1CC1)C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 16/20 0.43
▸ GRN P28799 1/20 0.40
▸ SORT1 Q99523 1/20 0.40
▸ HTT P42858 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ITGB1 P05556 1/20 0.39
▸ ITGA4 P13612 1/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ KMT2A Q03164 1/20 0.38

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
SCHEMBL31706737 0.91 GRN (0.39) P2RX7GRNSORT1ITGB1ITGA4
SCHEMBL31705761 0.91 P2RX7 (0.43) P2RX7GRNSORT1HTTCYP1A2
SCHEMBL31705744 0.90 P2RX7 (0.41) P2RX7HTTCYP1A2CYP3A4CYP2D6
SCHEMBL31706542 0.88 HTT (0.50) P2RX7GRNSORT1HTTCYP1A2
SCHEMBL31706282 0.87 P2RX7 (0.49) P2RX7GRNSORT1HTTCYP1A2
SCHEMBL31706967 0.86 GRN (0.43) P2RX7GRNSORT1HTTITGB1
SCHEMBL31705730 0.85 P2RX7 (0.45) P2RX7HTTCYP1A2CYP3A4CYP2D6
SCHEMBL30862571 0.85 GRN (0.36) P2RX7GRNSORT1ITGB1ITGA4
SCHEMBL31705653 0.84 ITGB1 (0.40) P2RX7GRNSORT1HTTITGB1
SCHEMBL31706978 0.84 ITGB1 (0.42) P2RX7GRNSORT1HTTITGB1

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-2025217020-A1 SUBSTITUTED 5-MEMBERED RING MOLECULES AND THEIR USE AS PESTICIDES CORTEVA AGRISCIENCE LLC (US) 2025-10-16 — — WO disclosed
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