SCHEMBL6622388

SCHEMBL6622388

COc1ccc(CCN2CCN(C(=O)c3ccc(Cl)cc3)CC2)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DRD2 P14416 4/20 0.54
▸ KCNA5 P22460 3/20 0.54
▸ DRD3 P35462 2/20 0.54
▸ MEN1 O00255 3/20 0.54
▸ KMT2A Q03164 3/20 0.54
▸ THRB P10828 1/20 0.52
▸ ALDH1A1 P00352 4/20 0.51
▸ KDM4E B2RXH2 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ HTT P42858 1/20 0.51
▸ LMNA P02545 2/20 0.50
▸ TSHR P16473 2/20 0.50
▸ HPGD P15428 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ ACHE P22303 1/20 0.49
▸ CCR8 P51685 1/20 0.49
▸ KCNH2 Q12809 1/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ SIGMAR1 Q99720 1/20 0.49
▸ HTR2A P28223 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
SCHEMBL5184351 0.86 KDM4E (0.57) DRD2KCNA5DRD3MEN1KMT2A
SCHEMBL6624933 0.85 DRD2 (0.56) DRD2KCNA5DRD3MEN1KMT2A
SCHEMBL9513235 0.77 KMT2A (0.67) DRD2KCNA5DRD3MEN1KMT2A
SCHEMBL31618101 0.76 HRH3 (0.68) KDM4EMAPTHTTLMNAHSD17B10
SCHEMBL3105480 0.76 ALDH1A1 (0.50) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL13157874 0.76 ALDH1A1 (0.50) MEN1KMT2AALDH1A1KDM4EMAPT
SCHEMBL4710417 0.75 MEN1 (0.51) DRD2KCNA5DRD3MEN1KMT2A
SCHEMBL9514261 0.75 DRD2 (0.76) DRD2KCNA5DRD3THRBSIGMAR1
SCHEMBL5240284 0.75 KCNA5 (0.55) DRD2KCNA5DRD3MEN1KMT2A
SCHEMBL5242494 0.75 KCNA5 (0.55) DRD2KCNA5DRD3MEN1KMT2A

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
Send feedback