SCHEMBL6962480

SCHEMBL6962480

COc1ccc(-c2cc(NC(=O)C3CCN(c4cccc(Cl)c4)CC3)n[nH]2)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 7/20 0.63
MAPT P10636 3/20 0.51
RXFP1 Q9HBX9 1/20 0.51
CHRNA3 P32297 2/20 0.49
KCNH2 Q12809 1/20 0.49
THRB P10828 1/20 0.48
CSNK2A2 P19784 1/20 0.48
CSNK2A1 P68400 1/20 0.48
LMNA P02545 1/20 0.47

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
SCHEMBL6967662 0.91 NPY5R (0.71) NPY5RCHRNA3KCNH2CSNK2A2CSNK2A1
SCHEMBL6961328 0.86 MAPT (0.56) NPY5RMAPTCHRNA3KCNH2THRB
SCHEMBL6962399 0.83 NPY5R (0.68) NPY5RMAPT
SCHEMBL6991250 0.80 NPY5R (0.79) NPY5RCHRNA3KCNH2CSNK2A2CSNK2A1
SCHEMBL6993059 0.78 NPY5R (0.80) NPY5RCHRNA3KCNH2CSNK2A2CSNK2A1
SCHEMBL7000363 0.78 NPY5R (1.00) NPY5RCHRNA3KCNH2CSNK2A2CSNK2A1
SCHEMBL6976896 0.78 NPY5R (0.54) NPY5RMAPT
SCHEMBL6956624 0.76 NPY5R (0.58) NPY5RMAPTCHRNA3KCNH2CSNK2A2
SCHEMBL6959277 0.75 RBP4 (0.53) NPY5RMAPTTHRBLMNA
SCHEMBL6996444 0.74 NPY5R (0.86) NPY5RCHRNA3KCNH2CSNK2A2CSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945439-B1 AMINOPYRAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-03-19 EP claimed
US-6166038-A Aminopyrazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US claimed
EP-0945439-A1 NOVEL AMINOPYRAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP claimed
EP-0945439-B1 AMINOPYRAZOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2003-03-19 EP disclosed
US-6166038-A Aminopyrazole derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-12-26 US disclosed
EP-0945439-A1 NOVEL AMINOPYRAZOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed