SCHEMBL14720734

SCHEMBL14720734

OC1CCOC(c2ccc(/C=C3/CCCN(C4CCC4)CC3)cc2)C1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 3/20 0.34
HRH3 Q9Y5N1 2/20 0.33

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
SCHEMBL14721515 0.80 HRH3 (0.33) HRH3
SCHEMBL14722836 0.73 HRH3 (0.41) SRD5A2HRH3
SCHEMBL14720353 0.71 HRH3 (0.36) SRD5A2HRH3
SCHEMBL14720602 0.71 HRH3 (0.36) SRD5A2HRH3
SCHEMBL14720603 0.71 HRH3 (0.36) SRD5A2HRH3
SCHEMBL14720966 0.71 HRH3 (0.36) SRD5A2HRH3
SCHEMBL14722284 0.71 HRH3 (0.44) SRD5A2HRH3
SCHEMBL14720720 0.70 SRD5A2 (0.58) SRD5A2HRH3
SCHEMBL14720811 0.69 HRH3 (0.36) SRD5A2HRH3
SCHEMBL14720813 0.69 HRH3 (0.36) SRD5A2HRH3

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
WO-2013027001-A1 COMPOUNDS AND THEIR USE TO TREAT HISTAMINE H3 RELATED DISORDERS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2013-02-28 WO disclosed