SCHEMBL30924140

SCHEMBL30924140

O=C(NCc1ccc(Br)cc1C(F)(F)F)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EPHX2 P34913 3/20 0.56
▸ SIGMAR1 Q99720 1/20 0.53
▸ CHRM2 P08172 2/20 0.51
▸ CHRM4 P08173 2/20 0.50
▸ CACNA1G O43497 1/20 0.50

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
SCHEMBL30924051 0.91 ERCC1 (0.59) EPHX2SIGMAR1CACNA1G
SCHEMBL30924144 0.90 EPHX2 (0.54) EPHX2SIGMAR1
SCHEMBL30924093 0.89 CACNA1G (0.58) EPHX2SIGMAR1CHRM2CHRM4CACNA1G
SCHEMBL30924058 0.88 EPHX2 (0.69) EPHX2CHRM4CACNA1G
SCHEMBL30924157 0.87 KDM4E (0.56) SIGMAR1CHRM2CHRM4CACNA1G
SCHEMBL30923925 0.87 EPHX2 (0.52) EPHX2
SCHEMBL30924103 0.86 CHRM4 (0.59) EPHX2CHRM2CHRM4
SCHEMBL30924102 0.85 ACKR3 (0.58) EPHX2SIGMAR1
SCHEMBL30924112 0.85 EPHX2 (0.77) EPHX2SIGMAR1CHRM4
SCHEMBL30924162 0.85 EPHX2 (0.59) EPHX2CHRM2CHRM4

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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