SCHEMBL31551643

SCHEMBL31551643

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

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 14/20 0.50
▸ SLC1A2 P43004 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.37
▸ POLB P06746 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.35

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
SCHEMBL31551565 0.95 P2RX7 (0.49) P2RX7SLC1A2GPR119POLBALDH1A1
SCHEMBL31551251 0.93 P2RX7 (0.47) P2RX7SLC1A2GPR119POLB
SCHEMBL31551262 0.93 P2RX7 (0.52) P2RX7SLC1A2GPR119POLBALDH1A1
SCHEMBL31551348 0.91 P2RX7 (0.46) P2RX7SLC1A2GPR119POLBALDH1A1
SCHEMBL31551602 0.91 P2RX7 (0.46) P2RX7SLC1A2GPR119POLBALDH1A1
SCHEMBL31551406 0.90 P2RX7 (0.48) P2RX7SLC1A2GPR119POLBALDH1A1
SCHEMBL31551503 0.90 P2RX7 (0.45) P2RX7SLC1A2ALDH1A1
SCHEMBL31551578 0.90 P2RX7 (0.45) P2RX7SLC1A2GPR119POLBALDH1A1
SCHEMBL31551509 0.90 P2RX7 (0.45) P2RX7SLC1A2ALDH1A1
SCHEMBL31551611 0.90 P2RX7 (0.48) P2RX7SLC1A2GPR119POLB

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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