SCHEMBL5862353

SCHEMBL5862353

COCCCCC1=CC(=O)NC1=O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.38
ALOX5 P09917 5/20 0.33
PTGS2 P35354 5/20 0.33
GLS2 Q9UI32 1/20 0.33
STAT3 P40763 1/20 0.32
ALDH1A1 P00352 4/20 0.31
HCAR2 Q8TDS4 1/20 0.31
ACHE P22303 1/20 0.30
BACE1 P56817 1/20 0.30
KDM4E B2RXH2 1/20 0.30
POLB P06746 1/20 0.30

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
SCHEMBL30834591 0.86 DAO (0.33) DAOALDH1A1HCAR2
SCHEMBL548121 0.86 STAT3 (0.35) STAT3ACHEBACE1
SCHEMBL29395797 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL10428620 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL549066 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL6910095 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL548131 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL10428730 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL549041 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE
SCHEMBL586641 0.84 STAT3 (0.39) ALOX5PTGS2GLS2STAT3ACHE

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-6987135-B2 Photoactivatable water borne coating composition AKZO NOBEL N.V. (NL) 2006-01-17 US disclosed
EP-1328565-B1 PHOTOACTIVATABLE WATER BORNE COATING COMPOSITION AKZO NOBEL COATINGS INT BV (NL) 2005-09-28 EP disclosed