SCHEMBL9302919

SCHEMBL9302919

NC(=O)C(c1ccc(OCc2ccc3ccccc3n2)cc1)C1CCCC1

nearest known ligand 0.82

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 20/20 0.82
HDAC6 Q9UBN7 1/20 0.82

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
SCHEMBL9303516 0.99 ALOX5 (0.83) ALOX5HDAC6
SCHEMBL26838881 0.90 ALOX5 (0.84) ALOX5HDAC6
Veliflapon SCHEMBL8798993 0.90 ALOX5 (1.00) ALOX5HDAC6
Veliflapon SCHEMBL502932 0.90 ALOX5 (1.00) ALOX5HDAC6
Veliflapon SCHEMBL30386644 0.90 ALOX5 (1.00) ALOX5HDAC6
Veliflapon SCHEMBL1004174 0.90 ALOX5 (1.00) ALOX5HDAC6
Veliflapon SCHEMBL29405516 0.90 ALOX5 (1.00) ALOX5HDAC6
SCHEMBL2109295 0.89 ALOX5 (1.00) ALOX5HDAC6
SCHEMBL7818529 0.89 ALOX5 (1.00) ALOX5HDAC6
SCHEMBL7818344 0.89 ALOX5 (1.00) ALOX5HDAC6

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-5310744-A Antiinflammatory BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US claimed
US-5310744-A Antiinflammatory BAYER AKTIENGESELLSCHAFT (DE) 1994-05-10 US disclosed
US-5288733-A Quinolylmethoxyphenylacetic acid acylamides and ureas BAYER AKTIENGESELLSCHAFT (DE) 1994-02-22 US disclosed