SCHEMBL30924099

SCHEMBL30924099

O=C(NCc1cccc(Cl)c1C(F)(F)F)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ACKR3 P25106 2/20 0.57
▸ SIGMAR1 Q99720 2/20 0.54
▸ CHRM2 P08172 1/20 0.53
▸ ALDH1A1 P00352 1/20 0.53
▸ CHRM4 P08173 2/20 0.53
▸ CACNA1G O43497 1/20 0.53

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
SCHEMBL30924154 0.91 KDM4E (0.58) SIGMAR1CHRM2ALDH1A1CHRM4CACNA1G
SCHEMBL30924149 0.87 ACKR3 (0.61) ACKR3SIGMAR1CHRM2ALDH1A1CHRM4
SCHEMBL30924105 0.86 P2RX7 (0.68) ACKR3SIGMAR1
SCHEMBL30924083 0.85 ACKR3 (0.62) ACKR3SIGMAR1ALDH1A1
SCHEMBL30924098 0.83 KDM4E (0.61) ACKR3SIGMAR1ALDH1A1CHRM4CACNA1G
SCHEMBL30924151 0.81 SIGMAR1 (0.57) ACKR3SIGMAR1ALDH1A1
SCHEMBL18657812 0.81 SIGMAR1 (0.65) SIGMAR1CHRM2CHRM4CACNA1G
SCHEMBL30924074 0.80 ACKR3 (0.59) ACKR3CHRM2ALDH1A1CHRM4CACNA1G
SCHEMBL30924093 0.79 CACNA1G (0.58) SIGMAR1CHRM2CHRM4CACNA1G
SCHEMBL30924136 0.79 SIGMAR1 (0.67) ACKR3SIGMAR1

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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