SCHEMBL9657015

SCHEMBL9657015

CCCCN(CCCC)CCCOc1ccc(S(=O)(=O)c2c(C3CCCCC3)cn3ccccc23)cc1

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 11/20 0.47
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
RECQL P46063 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL9599491 0.84 HRH3 (0.54) HRH3
Hydrochloric Acid SCHEMBL9600032 0.83 HRH3 (0.53) HRH3
SCHEMBL9656081 0.81 HRH3 (0.51) HRH3TSHRMAPK1
SCHEMBL8229020 0.81 HRH3 (0.51) HRH3
SCHEMBL9598567 0.81 HRH3 (0.51) HRH3
Hydrochloric Acid SCHEMBL9599538 0.81 HRH3 (0.50) HRH3TSHRMAPK1
Hydrochloric Acid SCHEMBL9598375 0.81 HRH3 (0.53) HRH3
SCHEMBL9656993 0.81 HRH3 (0.50) HRH3TSHRMAPK1
Oxalic Acid SCHEMBL10337873 0.80 HRH3 (0.50) HRH3
Hydrochloric Acid SCHEMBL9598260 0.80 HRH3 (0.52) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5147878-A Hypotensive, antiarrhythmia agents SANOFI (FR) 1992-09-15 US disclosed
US-5039700-A Cardiovascular disorders, antitumor agents SANOFI (FR) 1991-08-13 US disclosed
US-5017579-A Use of aminoalkoxyphenyl derivatives for reducing and/or controlling excessive intraocular pressure SANOFI (FR) 1991-05-21 US disclosed
US-4957925-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS, TREATMENT OF ANGINA SANOFI (FR) 1990-09-18 US disclosed