SCHEMBL7413694

SCHEMBL7413694

CCC(=O)N1CCN(CC[NH])CC1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.49
BLM P54132 1/20 0.43
GAA P10253 2/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
CHRNB3 Q05901 1/20 0.41
CHRNA6 Q15825 1/20 0.41
ALDH1A1 P00352 2/20 0.41
HRH2 P25021 1/20 0.41
HRH1 P35367 1/20 0.41
MEN1 O00255 1/20 0.38
TSHR P16473 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD11B1 P28845 3/20 0.38
EPHX2 P34913 2/20 0.38
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37

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
SCHEMBL24500534 0.83 DRD3 (0.51) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL10076105 0.82 DRD3 (0.50) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL11021059 0.80 DRD3 (0.49) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL24773181 0.80 HRH2 (0.53) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL7413697 0.80 ALOX15 (0.52) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL180620 0.80
SCHEMBL2739418 0.80 BLM (0.57) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL20756575 0.80 BLM (0.57) DRD3BLMGAACHRNB2CHRNA3
SCHEMBL7412564 0.79 CYP1A2 (0.54) DRD3ALDH1A1HTR7
SCHEMBL84852 0.79 HSD11B1 (0.55) DRD3BLMALDH1A1MEN1KMT2A

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
US-5273976-A Ocular hypotensive agents SANKYO COMPANY, LIMITED (JP) 1993-12-28 US disclosed
US-5175161-A Treatment of glaucoma SANKYO COMPANY, LIMITED (JP) 1992-12-29 US disclosed
EP-0391721-A2 Ocular hypotensive agents Sankyo Company Limited (JP) 1990-10-10 EP disclosed