SCHEMBL31332725

SCHEMBL31332725

CC(O)C1(c2cccc(Cl)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.44
SLC6A4 P31645 10/20 0.43
SLC6A2 P23975 9/20 0.43
SLC6A3 Q01959 8/20 0.43
CHRNA1 P02708 4/20 0.39
CHRNG P07510 4/20 0.39
CHRNB1 P11230 4/20 0.39
CHRNB2 P17787 4/20 0.39
CHRNB4 P30926 4/20 0.39
CHRNA3 P32297 4/20 0.39
CHRNA4 P43681 4/20 0.39
CHRND Q07001 4/20 0.39
DPP4 P27487 1/20 0.39
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
OPRK1 P41145 1/20 0.38
OPRL1 P41146 1/20 0.38
TSHR P16473 2/20 0.38
RECQL P46063 1/20 0.38
HDAC3 O15379 2/20 0.38

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
SCHEMBL5755205 0.88 OPRD1 (0.43) CCR2SLC6A4SLC6A2SLC6A3CHRNA1
SCHEMBL20684979 0.85 SLC6A3 (0.45) CCR2SLC6A4SLC6A2SLC6A3CHRNA1
SCHEMBL5756820 0.84 SLC6A4 (0.39) CCR2SLC6A4SLC6A2SLC6A3CHRNA1
SCHEMBL5790394 0.83 SLC6A3 (0.40) CCR2SLC6A4SLC6A2SLC6A3CHRNA1
SCHEMBL30174859 0.79 OPRM1 (0.46) CCR2SLC6A4SLC6A2SLC6A3OPRM1
SCHEMBL25518334 0.79 OPRM1 (0.46) CCR2SLC6A4SLC6A2SLC6A3OPRM1
SCHEMBL25094761 0.79 HDAC4 (0.41) SLC6A4SLC6A2SLC6A3OPRM1OPRD1
SCHEMBL30174956 0.78 SLC6A4 (0.40) CCR2SLC6A4SLC6A2SLC6A3CHRNA1
SCHEMBL25518294 0.78 SLC6A4 (0.40) CCR2SLC6A4SLC6A2SLC6A3CHRNA1
SCHEMBL7705762 0.77 SLC6A4 (0.55) CCR2SLC6A4SLC6A2SLC6A3OPRK1

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-4709708-A1 NOVEL CARBOXAMIDE DERIVATIVES ANGELINI PHARMA S.P.A. (IT) 2026-03-18 EP disclosed
WO-2024233603-A1 NOVEL CARBOXAMIDE DERIVATIVES ICAGEN, LLC (US) 2024-11-14 WO disclosed