SCHEMBL7470932

SCHEMBL7470932

Cc1cccc(C)c1NC(=O)CCCN1CCC(c2ccc(Oc3ccccc3)cc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.49
MCHR1 Q99705 1/20 0.48
DRD4 P21917 1/20 0.48
MMP3 P08254 1/20 0.48
S1PR1 P21453 1/20 0.47
DRD2 P14416 2/20 0.46
BCHE P06276 1/20 0.46
MAOA P21397 1/20 0.45
MAOB P27338 1/20 0.45
TP53 P04637 1/20 0.45
MAPT P10636 1/20 0.45
SCN4A P35499 2/20 0.44
PRCP P42785 1/20 0.44

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
SCHEMBL7474472 0.92 S1PR1 (0.46) HRH3MCHR1DRD4MMP3S1PR1
SCHEMBL7477194 0.88 DRD4 (0.59) DRD4MMP3DRD2MAPT
SCHEMBL7462774 0.82 S1PR1 (0.49) HRH3MMP3S1PR1DRD2
SCHEMBL7464080 0.80 DRD4 (0.55) DRD4MMP3DRD2MAPT
SCHEMBL7465032 0.78 S1PR1 (0.48) HRH3MMP3S1PR1BCHETP53
SCHEMBL12041705 0.77 HRH3 (0.55) HRH3MMP3S1PR1DRD2PRCP
SCHEMBL12041706 0.77 S1PR1 (0.69) HRH3MMP3S1PR1DRD2PRCP
SCHEMBL381548 0.76 S1PR1 (0.67) HRH3MMP3S1PR1DRD2PRCP
SCHEMBL7470302 0.75 MEN1 (0.60) DRD4MMP3DRD2MAPT
SCHEMBL6159068 0.74 DRD2 (0.81) HRH3MCHR1DRD4DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757986-B1 Arylpiperidine and arylpiperazine derivatives and drugs containing the same SUNTORY LTD (JP) 2002-06-12 EP disclosed
US-5723475-A Arylpiperidine and arylpiperazine derivatives and medicament containing the same SUNTORY LIMITED (JP) 1998-03-03 US disclosed
EP-0757986-A1 ARYLPIPERIDINE AND ARYLPIPERAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-12 EP disclosed