SCHEMBL14469579

SCHEMBL14469579

C=C(N)/C=C(\C=C/N)C(C)N1CCC(C(=O)N2CCN(S(=O)(=O)c3cccc(Cl)c3)CC2)CC1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 6/20 0.46
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ CHRM1 P11229 1/20 0.45
▸ F10 P00742 1/20 0.44
▸ ALDH1A1 P00352 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ GPR183 P32249 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPSR1 Q6W5P4 2/20 0.42
▸ USP2 O75604 1/20 0.42

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
SCHEMBL14469584 0.90 CNR1 (0.57) CNR1F10ALDH1A1MEN1LMNA
SCHEMBL14469593 0.87 CNR1 (0.45) CNR1HTTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL14469582 0.83 CNR1 (0.47) CNR1HTTSMN1; SMN2CHRM1F10
SCHEMBL14469240 0.74 CNR1 (0.58) CNR1F10MEN1LMNAKMT2A
SCHEMBL14456971 0.73 HTT (0.51) CNR1HTTSMN1; SMN2CHRM1F10
SCHEMBL14469197 0.73 CNR1 (0.44) CNR1HTTSMN1; SMN2ALDH1A1MEN1
SCHEMBL14469366 0.72 CNR1 (0.58) CNR1F10ALDH1A1LMNANPSR1
SCHEMBL14469583 0.71 POLB (0.53) CNR1HTTSMN1; SMN2ALDH1A1LMNA
SCHEMBL14469235 0.70 CNR1 (0.45) CNR1HTTSMN1; SMN2ALDH1A1KMT2A
SCHEMBL14469581 0.68 ALDH1A1 (0.45) CNR1ALDH1A1LMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007075555-A2 COMBINATION OF AN H3 ANTAGONIST/INVERSE AGONIST AND AN APPETITE SUPPRESSANT SCHERING CORPORATION (US) 2007-07-05 — — WO disclosed
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