SCHEMBL6624933

SCHEMBL6624933

COc1ccc(CCN2CCN(C(=O)c3ccc(Cl)cc3)CC2)c(C)c1C

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.56
▸ DRD3 P35462 4/20 0.56
▸ KCNA5 P22460 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ KDM4E B2RXH2 2/20 0.56
▸ MAPT P10636 2/20 0.56
▸ THRB P10828 1/20 0.54
▸ KMT2A Q03164 2/20 0.50
▸ POLB P06746 1/20 0.50
▸ MEN1 O00255 1/20 0.50
▸ LDHA P00338 1/20 0.50
▸ HTT P42858 1/20 0.50
▸ F10 P00742 3/20 0.48
▸ HPGD P15428 1/20 0.48

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
SCHEMBL6620732 0.88 KMT2A (0.50) DRD3ALDH1A1KDM4EMAPTKMT2A
SCHEMBL5242494 0.87 KCNA5 (0.55) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL5240284 0.87 KCNA5 (0.55) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL5240107 0.86 KCNA5 (0.54) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL5183896 0.86 LDHA (0.52) DRD2DRD3ALDH1A1KMT2AMEN1
SCHEMBL5242861 0.86 KCNA5 (0.51) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL6622388 0.85 DRD2 (0.54) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL5242627 0.85 KCNA5 (0.53) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL5244362 0.84 KCNA5 (0.52) DRD2DRD3KCNA5ALDH1A1KDM4E
SCHEMBL5241692 0.84 KCNA5 (0.52) DRD2DRD3KCNA5ALDH1A1KDM4E

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-1389189-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION (US) 2004-02-18 — — EP claimed
WO-2002094799-A2 MELANIN CONCENTRATING HORMONE RECEPTOR LIGANDS: SUBSTITUTED 1-BENZYL-4-ARYL PIPERAZINE ANALOGUES NEUROGEN CORPORATION (US) 2002-11-28 — — WO claimed
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