SCHEMBL31551380

SCHEMBL31551380

C=CCOC(=O)[C@H](CC1CC1)NC(=O)C[C@@H]1CCC(=O)N1Cc1cccc(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 8/20 0.42
▸ GPR119 Q8TDV5 1/20 0.33
▸ MAPT P10636 2/20 0.33
▸ HTT P42858 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CFD P00746 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ ITGB1 P05556 1/20 0.32
▸ ITGA4 P13612 1/20 0.32
▸ CAPN1 P07384 2/20 0.32
▸ LMNA P02545 1/20 0.32
▸ CHRM1 P11229 1/20 0.31

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
SCHEMBL31551250 0.91 P2RX7 (0.34) P2RX7GPR119GAACFDALDH1A1
SCHEMBL31551445 0.89 RIPK1 (0.33) P2RX7
SCHEMBL30862574 0.89 P2RX7 (0.47) P2RX7GPR119MAPTHTTGAA
SCHEMBL30862577 0.89 P2RX7 (0.47) P2RX7GPR119MAPTHTTGAA
SCHEMBL31551436 0.88 P2RX7 (0.43) P2RX7MAPTHTTGAAMEN1
SCHEMBL31551636 0.88 P2RX7 (0.42) P2RX7GPR119CAPN1
SCHEMBL31551263 0.88 P2RX7 (0.42) P2RX7MAPTHTTGAAMEN1
SCHEMBL31551408 0.87 P2RX7 (0.42) P2RX7MAPTHTTGAAMEN1
SCHEMBL31551519 0.87 P2RX7 (0.42) P2RX7MAPTHTTGAAMEN1
SCHEMBL31551424 0.86 P2RX7 (0.41) P2RX7HTTMEN1KMT2AALDH1A1

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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