SCHEMBL31705293

SCHEMBL31705293

CC(C)[C@H](NC(=O)C[C@@H]1CCC(=O)N1Cc1ccccc1F)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC1A2 P43004 1/20 0.44
▸ P2RX7 Q99572 1/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ SIGMAR1 Q99720 2/20 0.39
▸ RAB9A P51151 2/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ POLB P06746 2/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ ITGB1 P05556 1/20 0.37
▸ ITGA4 P13612 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL31551291 0.92 P2RX7 (0.50) SLC1A2P2RX7ALDH1A1POLB
SCHEMBL31706280 0.91 P2RX7 (0.41) P2RX7
SCHEMBL31706976 0.91 SLC1A2 (0.39) SLC1A2P2RX7KMT2ASIGMAR1RAB9A
SCHEMBL31706020 0.90 SLC1A2 (0.43) SLC1A2P2RX7KMT2ARAB9AALDH1A1
SCHEMBL31705296 0.88 P2RX7 (0.40) P2RX7SIGMAR1RAB9AALDH1A1CYP2D6
SCHEMBL31706553 0.88 CYP2D6 (0.48) P2RX7KMT2AALDH1A1CYP2D6CYP2C9
SCHEMBL31706273 0.87 SDCBP (0.40) P2RX7KMT2AALDH1A1MEN1GAA
SCHEMBL31705414 0.87 P2RX7 (0.52) P2RX7KMT2AALDH1A1CYP2D6CYP2C9
SCHEMBL31705403 0.86 ITGB1 (0.46) P2RX7ALDH1A1CYP2D6CYP2C9TSHR
SCHEMBL31551176 0.84 RIPK1 (0.37) P2RX7ALDH1A1CYP2D6CYP2C9TSHR

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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