Piperidine

Piperidine

SCHEMBL742276

C1CCNCC1.COCCCn1c([C@@H]2CCCNC2)nc2ccccc21

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 7/20 0.67
CHRM1 P11229 3/20 0.67
REN P00797 1/20 0.51
OPRM1 P35372 2/20 0.49
OPRD1 P41143 2/20 0.49
OPRK1 P41145 2/20 0.49
OPRL1 P41146 2/20 0.49
KCNH2 Q12809 3/20 0.47
USP2 O75604 1/20 0.47
POLB P06746 1/20 0.47
NPY1R P25929 2/20 0.43
TAAR1 Q96RJ0 1/20 0.43

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
SCHEMBL739843 0.97 HRH1 (0.70) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL739842 0.97 HRH1 (0.70) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL763158 0.85 HRH1 (0.68) HRH1CHRM1OPRM1OPRD1OPRK1
SCHEMBL741971 0.84 HRH1 (0.53) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL740713 0.84 HRH1 (0.53) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL741972 0.84 HRH1 (0.53) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL740712 0.84 HRH1 (0.53) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL742774 0.83 HRH1 (0.54) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL740756 0.83 HRH1 (0.52) HRH1CHRM1RENOPRM1OPRD1
SCHEMBL742773 0.83 HRH1 (0.54) HRH1CHRM1RENOPRM1OPRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138168-B1 Renin inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-03-20 US disclosed