SCHEMBL10555657

SCHEMBL10555657

Nc1cc(CCN2CCCCC2)ccc1OCc1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 4/20 0.61
SIGMAR1 Q99720 5/20 0.55
SLC6A3 Q01959 2/20 0.53
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
LTA4H P09960 3/20 0.49
EBP Q15125 2/20 0.46
TMEM97 Q5BJF2 1/20 0.46
APP P05067 1/20 0.46

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
SCHEMBL10553555 1.00 HRH3 (0.61) HRH3SIGMAR1SLC6A3MEN1KMT2A
SCHEMBL10556006 0.99 HRH3 (0.63) HRH3SIGMAR1SLC6A3MEN1KMT2A
SCHEMBL10560091 0.82 HRH3 (0.43) HRH3SIGMAR1EBPTMEM97
SCHEMBL10556225 0.81 HRH3 (0.41) HRH3SIGMAR1MEN1KMT2AEBP
SCHEMBL10923941 0.80 SIGMAR1 (0.54) HRH3SIGMAR1MEN1KMT2A
SCHEMBL10922973 0.80 SIGMAR1 (0.54) HRH3SIGMAR1MEN1KMT2A
SCHEMBL10556018 0.80 HMOX1 (0.44) HRH3LTA4HAPP
SCHEMBL10554521 0.80 POLB (0.61) HRH3SIGMAR1SLC6A3MEN1KMT2A
SCHEMBL10554135 0.80 POLB (0.61) HRH3SIGMAR1SLC6A3MEN1KMT2A
SCHEMBL18159245 0.80 SIGMAR1 (0.57) HRH3SIGMAR1EBPTMEM97

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4847269-A GLAUCOMA, AMIDES OR UREA DERIVATIVES OF AMINOETHYLCARBOXY COMPOUNDS SYNTEX (U.S.A.) INC. (US) 1989-07-11 US disclosed
US-4629730-A ADMINISTERING DIALKYL OR CYCLOAKYL AMINO ETHYLANILINE DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1986-12-16 US disclosed
EP-0180994-A2 Antihypertensive dialkyl aminoethylaniline derivatives SYNTEX (U.S.A.) INC. (US) 1986-05-14 EP disclosed