SCHEMBL30924073

SCHEMBL30924073

N#Cc1ccc(CNC(=O)C2CCN(Cc3ccccc3)CC2)c(Cl)c1

nearest known ligand 0.64

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CHRM4 P08173 7/20 0.59
▸ ALDH1A1 P00352 2/20 0.57
▸ ACKR3 P25106 1/20 0.56
▸ CHRM2 P08172 1/20 0.54
▸ P2RX7 Q99572 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
SCHEMBL30924119 0.91 P2RX7 (0.52) CHRM4ALDH1A1ACKR3P2RX7
SCHEMBL30924141 0.90 ERCC1 (0.60) CHRM4CHRM2P2RX7
SCHEMBL30924146 0.87 ACKR3 (0.53) CHRM4ALDH1A1ACKR3CHRM2P2RX7
SCHEMBL30924038 0.87 P2RX7 (0.48) CHRM4ALDH1A1ACKR3P2RX7
SCHEMBL30924136 0.87 SIGMAR1 (0.67) ACKR3P2RX7
SCHEMBL30924103 0.86 CHRM4 (0.59) CHRM4CHRM2
SCHEMBL12685848 0.86 CHRM4 (0.67) CHRM4ALDH1A1ACKR3
SCHEMBL30924102 0.85 ACKR3 (0.58) ALDH1A1ACKR3P2RX7
SCHEMBL30924104 0.84 CHRM2 (0.62) CHRM4CHRM2
SCHEMBL30924135 0.82 BCHE (0.61) CHRM4ALDH1A1ACKR3

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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