SCHEMBL3376760

SCHEMBL3376760

CN(CC1CC(Oc2ccc(CN3CCCC3)c(Cl)c2)C1)S(=O)(=O)c1ccc2[nH]c(=O)oc2c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALPL P05186 4/20 0.44
POLB P06746 3/20 0.44
ALPI P09923 2/20 0.44
ALPG P10696 2/20 0.44
MAPT P10636 2/20 0.43
KMT2A Q03164 5/20 0.43
MEN1 O00255 3/20 0.43
RAB9A P51151 1/20 0.43
TSHR P16473 2/20 0.41
LMNA P02545 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
GLRA3 O75311 1/20 0.38
GLRA1 P23415 1/20 0.38
GLRB P48167 1/20 0.38
TP53 P04637 1/20 0.38

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
SCHEMBL3380902 0.85 ALPL (0.43) ALPLPOLBALPIALPGMAPT
SCHEMBL3376046 0.84 HRH3 (0.44) POLBMAPTKMT2AMEN1TSHR
SCHEMBL3377343 0.83 SOS1 (0.44) POLBHRH3
SCHEMBL3378015 0.83 HRH3 (0.45) POLBHRH3TP53
SCHEMBL3380289 0.83 HRH3 (0.41) MAPTKMT2AMEN1TSHRLMNA
SCHEMBL3380356 0.82 HRH3 (0.42) TSHRLMNAHRH3
SCHEMBL3376233 0.81 HRH3 (0.42) POLBLMNAHRH3
SCHEMBL3377859 0.81 HRH3 (0.44) POLBHRH3
SCHEMBL3378936 0.81 HRH3 (0.48) POLBKMT2AHRH3
SCHEMBL3377762 0.80 HRH3 (0.41) 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
EP-1899296-B1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PROD INC (US) 2010-11-17 EP claimed