SCHEMBL30862570

SCHEMBL30862570

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

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ P2RX7 Q99572 12/20 0.47
▸ POLB P06746 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.36
▸ CYP2D6 P10635 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 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
SCHEMBL31551595 0.97 P2RX7 (0.44) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL31551635 0.94 P2RX7 (0.47) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL31551455 0.94 P2RX7 (0.45) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL31551479 0.93 P2RX7 (0.43) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL31551196 0.93 P2RX7 (0.43) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL30862575 0.93 P2RX7 (0.47) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL31705395 0.93 SLC1A2 (0.39) P2RX7POLBMEN1KMT2ACYP2D6
SCHEMBL30862585 0.93 P2RX7 (0.48) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL30862586 0.93 P2RX7 (0.48) P2RX7POLBALDH1A1MEN1KMT2A
SCHEMBL31551621 0.92 P2RX7 (0.46) P2RX7POLBALDH1A1MEN1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4601471-A1 SUBSTITUTED 5-MEMBERED RINGS AND THEIR USE AS PESTICIDES Corteva Agriscience LLC (US) 2025-08-20 — — EP disclosed
WO-2025080861-A1 5-MEMBERED RING-BASED MOLECULES AND THEIR USE AS HERBICIDES CORTEVA AGRISCIENCE LLC (US) 2025-04-17 — — WO disclosed
WO-2024081762-A1 SUBSTITUTED 5-MEMBERED RINGS AND THEIR USE AS PESTICIDES CORTEVA AGRISCIENCE LLC (US) 2024-04-18 — — WO disclosed
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