SCHEMBL8533781

SCHEMBL8533781

COCC1CCCN1C(=O)CC1CCc2cc(C)c(C)cc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
PLAT P00750 1/20 0.38
HTR7 P34969 1/20 0.37
CASP3 P42574 1/20 0.36
CASP7 P55210 1/20 0.36
POLB P06746 2/20 0.36
DPP4 P27487 2/20 0.35
DPP8 Q6V1X1 2/20 0.35
CRHR1 P34998 1/20 0.35
CYP26A1 O43174 1/20 0.34
CYP24A1 Q07973 1/20 0.34
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34

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
SCHEMBL8534988 0.79 CYP11B1 (0.41) CYP26A1CYP11B1CYP11B2
SCHEMBL8531874 0.75 DGAT1 (0.36) CYP26A1CYP24A1
SCHEMBL8534684 0.73 DGAT1 (0.50) CYP26A1CYP24A1
SCHEMBL20804911 0.67 DPP4 (0.47) ROCK2ROCK1POLBDPP4DPP8
SCHEMBL13077117 0.67 DPP4 (0.47) ROCK2ROCK1POLBDPP4DPP8
SCHEMBL19321965 0.67 HTR7 (0.57) ROCK2PLATHTR7POLB
SCHEMBL13662567 0.67 ROCK2 (0.46) ROCK2ROCK1PLATPOLBDPP4
SCHEMBL10272737 0.67 ROCK2 (0.46) ROCK2ROCK1PLATPOLBDPP4
SCHEMBL13189047 0.66 DPP4 (0.49) ROCK2ROCK1POLBDPP4DPP8
SCHEMBL4023639 0.65 POLB (0.46) ROCK2ROCK1PLATPOLBDPP4

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
US-5847159-A 1- ω-(3,4-dihydro-2-naphthalenyl)alkyl!-cyclic amine derivatives, process for preparing the same, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-12-08 US disclosed
EP-0825180-A1 1-OMEGA-(3,4-DIHYDRO-2-NAPHTHALENYL)ALKYL] CYCLIC AMINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, AND MEDICINAL COMPOSITION CONTAINING THE SAME DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1998-02-25 EP disclosed