SCHEMBL8293176

SCHEMBL8293176

c1cc(CC2CCCC2)ccn1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 13/20 0.57
TRPA1 O75762 1/20 0.50
TSHR P16473 1/20 0.47
RECQL P46063 1/20 0.47
CYP11B2 P19099 1/20 0.47
AAK1 Q2M2I8 2/20 0.44
PKM P14618 1/20 0.42

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
SCHEMBL8910496 0.98 CYP19A1 (0.55) CYP19A1TRPA1TSHRRECQLCYP11B2
SCHEMBL4864390 0.95 CYP19A1 (0.57) CYP19A1TRPA1TSHRRECQLCYP11B2
SCHEMBL1000330 0.91 CYP19A1 (0.61) CYP19A1TRPA1CYP11B2
SCHEMBL17493873 0.88 AAK1 (0.54) CYP19A1TRPA1TSHRRECQLCYP11B2
SCHEMBL14174294 0.81 CYP19A1 (0.52) CYP19A1TRPA1CYP11B2
SCHEMBL16612734 0.81 CYP19A1 (0.52) CYP19A1TRPA1CYP11B2
SCHEMBL2109582 0.81 GBA1 (0.66) CYP19A1CYP11B2
Hydrochloric Acid SCHEMBL1550607 0.79 GBA1 (0.63) CYP19A1CYP11B2
SCHEMBL16612252 0.79 CYP19A1 (0.56) CYP19A1CYP11B2
SCHEMBL28022000 0.79 HRH3 (0.54) CYP19A1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0848707-B1 4-(CYCLOALKYL)PIPERIDINES AND 4-(CYCLOALKYLALKYL)-PIPERIDINES DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL APPLICATIONS THEREOF SYNTHELABO (FR) 1999-08-04 EP disclosed
EP-0848707-A1 4-(CYCLOALKYL)PIPERIDINES AND 4-(CYCLOALKYLALKYL)-PIPERIDINES DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL APPLICATIONS THEREOF SYNTHELABO (FR) 1998-06-24 EP disclosed
WO-1997009309-A1 4-(CYCLOALKYL)PIPERIDINE AND 4-(CYCLOALKYLALKYL)PIPERIDINE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTICAL APPLICATIONS THEREOF SYNTHELABO (FR) 1997-03-13 WO disclosed
WO-1992000760-A1 METHOD OF TREATING NEUROLOGICAL DYSFUNCTION USING NEUROTRANSMITTER ENHANCES THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1992-01-23 WO disclosed