SCHEMBL9535263

SCHEMBL9535263

CCOC(=O)CCCN1CCC(OCc2ccccc2-c2ccc(Cl)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 3/20 0.52
PRMT6 Q96LA8 3/20 0.52
BCHE P06276 5/20 0.48
NPY1R P25929 1/20 0.45
HTR4 Q13639 2/20 0.44
HTR7 P34969 1/20 0.43
FFAR4 Q5NUL3 1/20 0.42
HRH2 P25021 1/20 0.42
HRH1 P35367 1/20 0.42
CHRM3 P20309 4/20 0.41
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41

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
SCHEMBL9181177 0.84 HTR7 (0.51) HTR7HRH2HRH1
SCHEMBL9352867 0.80 CARM1 (0.54) CARM1PRMT6BCHEFFAR4HRH2
SCHEMBL4024133 0.80 BCHE (0.62) CARM1PRMT6BCHEHTR4
Hydrochloric Acid SCHEMBL9353143 0.78 CARM1 (0.54) CARM1PRMT6BCHEHTR7FFAR4
SCHEMBL9356788 0.76 CARM1 (0.51) CARM1PRMT6BCHEFFAR4HRH1
SCHEMBL9531532 0.76 BCHE (0.65) BCHEHRH2HRH1CHRM3
SCHEMBL7949172 0.75 DRD2 (0.61)
SCHEMBL10435992 0.75 CARM1 (0.46) CARM1PRMT6BCHEHTR7FFAR4
SCHEMBL9352689 0.74 CARM1 (0.57) CARM1PRMT6BCHEFFAR4CHRM3
SCHEMBL21206426 0.74 BCHE (0.54) CARM1PRMT6BCHEHTR4

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
EP-0335586-B1 PIPERIDINE & PIPERAZINE DERIVATIVES, PROCESS FOR PREPARING THE SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME UBE INDUSTRIES, LTD. (JP) 1993-06-02 EP disclosed
EP-0335586-A1 Piperidine & piperazine derivatives, process for preparing the same and pharmaceutical compositions containing the same UBE INDUSTRIES, LTD. (JP) 1989-10-04 EP disclosed