SCHEMBL30924062

SCHEMBL30924062

COc1ccc(CN2CCC(C(=O)NCc3ccc(F)cc3C(F)(F)F)CC2)cc1

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 10/20 0.70
▸ ACHE P22303 2/20 0.62
▸ CACNA1G O43497 2/20 0.61
▸ ERCC1 P07992 1/20 0.54
▸ ERCC4 Q92889 1/20 0.54
▸ P2RX7 Q99572 4/20 0.52

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
SCHEMBL30924133 0.91 ERCC1 (0.64) EPHX2CACNA1GERCC1ERCC4P2RX7
SCHEMBL30924132 0.91 ERCC1 (0.64) EPHX2CACNA1GERCC1ERCC4P2RX7
SCHEMBL30924137 0.91 EPHX2 (0.70) EPHX2ACHECACNA1G
SCHEMBL30924138 0.91 EPHX2 (0.70) EPHX2ACHECACNA1G
SCHEMBL30924058 0.90 EPHX2 (0.69) EPHX2ACHECACNA1G
SCHEMBL30924072 0.88 EPHX2 (0.67) EPHX2ACHECACNA1G
SCHEMBL30924112 0.88 EPHX2 (0.77) EPHX2ACHE
SCHEMBL30924015 0.88 ERCC1 (0.57) EPHX2CACNA1GERCC1ERCC4P2RX7
SCHEMBL30924093 0.88 CACNA1G (0.58) EPHX2CACNA1GERCC1ERCC4P2RX7
SCHEMBL30924107 0.85 ERCC1 (0.60) EPHX2CACNA1GERCC1ERCC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4618985-A1 DUAL INHIBITORS OF SIGMA-1 RECEPTOR AND SOLUBLE EPOXIDE HYDROLASE AND THEIR USE IN THE TREATMENT OF PAIN Universitat De Barcelona (ES) 2025-09-24 — — EP disclosed
WO-2024105234-A1 DUAL INHIBITORS OF SIGMA-1 RECEPTOR AND SOLUBLE EPOXIDE HYDROLASE AND THEIR USE IN THE TREATMENT OF PAIN UNIVERSITAT DE BARCELONA (ES) 2024-05-23 — — WO disclosed
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