SCHEMBL25809571

SCHEMBL25809571

CC1CCC(OC2CCN(C(C)C)CC2)CC1

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 19/20 0.39

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
SCHEMBL12026450 0.81 HRH3 (0.45) HRH3
SCHEMBL20231209 0.80 HRH3 (0.36) HRH3
SCHEMBL21477143 0.80 HRH3 (0.36) HRH3
SCHEMBL105496 0.79 ALDH1A1 (0.41) HRH3
SCHEMBL4717445 0.78 HRH3 (0.47) HRH3
SCHEMBL24246546 0.76 CYP19A1 (0.31)
SCHEMBL9910586 0.76 CYP19A1 (0.31)
SCHEMBL15080518 0.76 CYP19A1 (0.31)
SCHEMBL21673538 0.76 HRH3 (0.37) HRH3
Hydrochloric Acid SCHEMBL5209546 0.76 HRH3 (0.46) 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-2023118319-A1 RIFABUTIN ANALOGS FOR THE TREATMENT OF DISEASE BioVersys AG (CH) 2023-06-29 WO disclosed