SCHEMBL31705151

SCHEMBL31705151

COC(=O)[C@@H](NC(=O)C[C@@H]1CCC(=O)N1Cc1cc(F)cc(Cl)c1)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 2/20 0.39
▸ CYP2D6 P10635 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ TSHR P16473 1/20 0.38
▸ P2RX7 Q99572 4/20 0.37
▸ KMT2A Q03164 4/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ PSMB5 P28074 1/20 0.34
▸ HCRTR2 O43614 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ P2RX3 P56373 2/20 0.34

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
SCHEMBL31706114 0.93 KMT2A (0.39) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31705678 0.93 KMT2A (0.38) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31706035 0.91 METAP2 (0.40) METAP2CYP2D6CYP2C19ALDH1A1CYP2C9
SCHEMBL31707058 0.86 P2RX7 (0.46) P2RX7KMT2AMEN1PSMB5
SCHEMBL31705783 0.86 CTSL (0.44) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31705304 0.86 CTSL (0.36) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31705324 0.85 P2RX7 (0.36) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31706821 0.84 SDCBP (0.38) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31705802 0.84 KMT2A (0.49) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR
SCHEMBL31705736 0.84 TSHR (0.39) CYP2D6CYP2C19ALDH1A1CYP2C9TSHR

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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