SCHEMBL8034993

SCHEMBL8034993

CCOC(C)/C=C1\COc2ccc(OCc3ccc4ccccc4n3)cc2C1=O

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.47
CYSLTR1 Q9Y271 6/20 0.44
GPBAR1 Q8TDU6 5/20 0.44
CYSLTR2 Q9NS75 4/20 0.44
PDE10A Q9Y233 3/20 0.42
CYP1A2 P05177 1/20 0.40

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
SCHEMBL8034999 1.00 ALOX5 (0.47) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8034997 1.00 ALOX5 (0.47) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8034921 0.84 ALOX5 (0.53) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8034925 0.84 ALOX5 (0.53) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8029106 0.82 CYSLTR1 (0.53) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8029102 0.82 CYSLTR1 (0.53) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8029331 0.79 CYSLTR2 (0.57) ALOX5CYSLTR1GPBAR1CYSLTR2
SCHEMBL8029337 0.79 CYSLTR2 (0.57) ALOX5CYSLTR1GPBAR1CYSLTR2
SCHEMBL7801525 0.79 MAPT (0.56) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A
SCHEMBL8029126 0.78 ALOX5 (0.48) ALOX5CYSLTR1GPBAR1CYSLTR2PDE10A

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-6166031-A Substituted tetralins, chromans and related compounds in the treatment of asthma PFIZER INC, (US) 2000-12-26 US disclosed
WO-1989003681-A1 SUBSTITUTED TETRALINS, CHROMANS AND RELATED COMPOUNDS IN THE TREATMENT OF ASTHMA PFIZER INC. (US) 1989-05-05 WO disclosed