SCHEMBL9760411

SCHEMBL9760411

CN(CCCl)C(=O)N1CCCC1

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 13/20 0.44
MAPT P10636 1/20 0.36
TSHR P16473 1/20 0.36
GFER P55789 1/20 0.36

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
SCHEMBL9760358 0.83 HRH3 (0.43) HRH3
SCHEMBL26725202 0.82 HRH3 (0.46) HRH3
SCHEMBL3345211 0.82 HRH3 (0.46) HRH3
SCHEMBL3347181 0.79 HRH3 (0.40) HRH3
SCHEMBL14557432 0.78 HTR1A (0.45) HRH3MAPT
SCHEMBL2482261 0.77 HRH3 (0.43) HRH3
SCHEMBL29626142 0.77 HTR1A (0.44) HRH3
SCHEMBL15904342 0.77 HRH3 (0.41) HRH3MAPTTSHRGFER
SCHEMBL3263872 0.75 HRH3 (0.43) HRH3
Hydrochloric Acid SCHEMBL10806950 0.75 HTR1A (0.42) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5041454-A Stimulate gastrointestinal motility JANSSEN PHARMACEUTICA N.V. (BE) 1991-08-20 US disclosed
US-4975439-A Gastrointestinal motility stimulating properties JANSSEN PHARMACEUTICAL N.V. (BE) 1990-12-04 US disclosed