SCHEMBL14469584

SCHEMBL14469584

C=C(N)/C=C(\C=C/N)C(C)N1CCC(C(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)CC1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.57
▸ NPSR1 Q6W5P4 1/20 0.54
▸ GAA P10253 1/20 0.51
▸ CTDSP1 Q9GZU7 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ PKM P14618 1/20 0.45
▸ F10 P00742 1/20 0.44
▸ F13A1 P00488 1/20 0.43
▸ TGM2 P21980 1/20 0.43
▸ TGM1 P22735 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL14469579 0.90 CNR1 (0.46) CNR1NPSR1ALDH1A1F10MEN1
SCHEMBL14469593 0.89 CNR1 (0.45) CNR1NPSR1GAAALDH1A1KMT2A
SCHEMBL14469366 0.81 CNR1 (0.58) CNR1NPSR1GAAALDH1A1PKM
SCHEMBL14456962 0.75 CNR1 (0.65) CNR1NPSR1GAAALDH1A1PKM
SCHEMBL14469581 0.74 ALDH1A1 (0.45) CNR1NPSR1GAAALDH1A1PKM
SCHEMBL14469240 0.73 CNR1 (0.58) CNR1NPSR1GAAF10MEN1
SCHEMBL14469583 0.72 POLB (0.53) CNR1NPSR1GAAALDH1A1PKM
SCHEMBL14469582 0.72 CNR1 (0.47) CNR1NPSR1F10
SCHEMBL14456968 0.71 CNR1 (0.58) CNR1NPSR1GAAALDH1A1PKM
SCHEMBL14469235 0.71 CNR1 (0.45) CNR1NPSR1GAAALDH1A1KMT2A

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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