SCHEMBL6607904

SCHEMBL6607904

CC(O)(c1ccc(F)cc1)C1CCN(CCc2cccs2)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.44
SIGMAR1 Q99720 1/20 0.43
HRH3 Q9Y5N1 2/20 0.43
OPRM1 P35372 2/20 0.41
OPRD1 P41143 2/20 0.41
OPRK1 P41145 2/20 0.41
KCNH2 Q12809 1/20 0.40

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
SCHEMBL6606776 0.82 HRH1 (0.56) HRH1
SCHEMBL6603645 0.81 HRH1 (0.41) HRH1KCNH2
SCHEMBL6606267 0.80 HRH1 (0.64) HRH1KCNH2
SCHEMBL6605503 0.77 HRH1 (0.51) HRH1
SCHEMBL11103654 0.74 CHRM3 (0.42)
SCHEMBL6603656 0.74 HTR2A (0.51) HRH1SIGMAR1OPRK1KCNH2
SCHEMBL13621141 0.73 HRH3 (0.60) SIGMAR1HRH3OPRM1OPRD1OPRK1
SCHEMBL15866342 0.73 HRH3 (0.52) HRH3OPRM1OPRD1OPRK1KCNH2
SCHEMBL6605812 0.72 HRH1 (0.51) HRH1KCNH2
SCHEMBL6604479 0.71 HRH1 (0.42) HRH1KCNH2

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
CN-1170819-C Piperidine alcohols Ĭ��ר���ɷ����޹�˾ 2004-10-13 CN disclosed
US-6756370-B1 POTENT 5-HT2A RECEPTOR ANTAGONISTS MERCK PATENT GMBH (DE) 2004-06-29 US disclosed
EP-1202966-B1 PIPERIDINE ALCOHOLS MERCK PATENT GMBH (DE) 2004-06-09 EP disclosed
CN-1371365-A Piperidine alcohols MERCK PATENT GMBH (DE) 2002-09-25 CN disclosed
EP-1202966-A1 PIPERIDINE ALCOHOLS MERCK PATENT GmbH (DE) 2002-05-08 EP disclosed
WO-2001014332-A1 PIPERIDINE ALCOHOLS MERCK PATENT GMBH (DE) 2001-03-01 WO disclosed