SCHEMBL4780419

SCHEMBL4780419

CC(C)N1CCC(Oc2ccc(CC=O)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 20/20 0.67

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
SCHEMBL17303468 0.84 HRH3 (0.72) HRH3
SCHEMBL5207844 0.82 HRH3 (0.61) HRH3
SCHEMBL17873485 0.81 ALDH1A1 (0.46) HRH3
SCHEMBL5204296 0.80 HRH3 (1.00) HRH3
SCHEMBL5206626 0.80 HRH3 (0.78) HRH3
SCHEMBL5207784 0.79 HRH3 (1.00) HRH3
SCHEMBL12030651 0.79 HRH3 (0.68) HRH3
SCHEMBL737003 0.79 HRH3 (0.68) HRH3
SCHEMBL5202720 0.78 HRH3 (1.00) HRH3
SCHEMBL5205619 0.78 HRH3 (1.00) HRH3

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-2008064036-A1 SUBSTITUTED PHENYL PROPYL AMINES AS HISTAMINE H3 RECEPTOR AND SEROTONIN TRANSPORTER MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2008-05-29 WO disclosed