SCHEMBL10696449

SCHEMBL10696449

Cc1c(CC(=O)NO)cccc1OCc1ccc2ccccc2n1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYSLTR1 Q9Y271 4/20 0.48
CYSLTR2 Q9NS75 2/20 0.47
HDAC1 Q13547 2/20 0.46
HDAC2 Q92769 2/20 0.46
GPBAR1 Q8TDU6 2/20 0.46
ALOX5 P09917 2/20 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
SCHEMBL10694503 0.87 CYSLTR1 (0.52) CYSLTR1CYSLTR2GPBAR1ALOX5
SCHEMBL10693643 0.84 CYSLTR1 (0.47) CYSLTR1CYSLTR2HDAC1HDAC2GPBAR1
SCHEMBL10695747 0.82 CYSLTR1 (0.50) CYSLTR1CYSLTR2GPBAR1
SCHEMBL9636913 0.78 CYSLTR1 (0.58) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7710953 0.78 CYSLTR1 (0.53) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7452392 0.77 CYSLTR1 (0.54) CYSLTR1CYSLTR2GPBAR1
SCHEMBL7921075 0.76 GPBAR1 (0.53) CYSLTR1CYSLTR2GPBAR1ALOX5
SCHEMBL7593150 0.76 GPBAR1 (0.56) CYSLTR1CYSLTR2GPBAR1ALOX5
SCHEMBL9847314 0.75 CYSLTR1 (0.58) CYSLTR1CYSLTR2GPBAR1
SCHEMBL10696181 0.75 ALOX5 (0.69) CYSLTR1CYSLTR2GPBAR1ALOX5

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-4769461-A Quinolinyl benzene hydroxamic acids as anti-inflammatory/antiallergic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1988-09-06 US claimed
US-4769461-A Quinolinyl benzene hydroxamic acids as anti-inflammatory/antiallergic agents AMERICAN HOME PRODUCTS CORPORATION (US) 1988-09-06 US disclosed