SCHEMBL31706320

SCHEMBL31706320

COC(=O)C[C@@H]1CCC(=O)N1Cc1cccc(Cl)c1F

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 11/20 0.56
CYP2D6 P10635 4/20 0.47
CYP2C19 P33261 4/20 0.47
CYP2C9 P11712 3/20 0.47
HTT P42858 3/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CYP3A4 P08684 3/20 0.43
CYP1A2 P05177 2/20 0.43
ALDH1A1 P00352 2/20 0.43
LMNA P02545 1/20 0.43
GFER P55789 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL30157991 1.00 P2RX7 (0.56) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL30158069 0.89 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9
SCHEMBL30862582 0.89 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9
SCHEMBL31706616 0.89 CYP2D6 (0.58) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL31706022 0.87 P2RX7 (0.44) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL24810886 0.86 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL24769849 0.86 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL31707067 0.86 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL29875113 0.86 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9HTT
SCHEMBL29874953 0.86 P2RX7 (0.54) P2RX7CYP2D6CYP2C19CYP2C9HTT

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