SCHEMBL5764439

SCHEMBL5764439

O=C(O)C(=NOCC1(c2cccc3c2oc2ccccc23)C=CC(c2ccccc2)=CC1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.33
ALOX5 P09917 1/20 0.31
ALDH1A1 P00352 1/20 0.30
HPGD P15428 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
SCHEMBL5744684 0.74 ALOX5 (0.32) MAPTALOX5
SCHEMBL5200688 0.69 PPARA (0.42)
SCHEMBL5262506 0.69 EPHX2 (0.33)
SCHEMBL4824304 0.68 ICMT (0.36) MAPTALDH1A1
SCHEMBL4275190 0.66 ALOX5 (0.43) ALOX5
SCHEMBL4275188 0.66 ALOX5 (0.43) ALOX5
SCHEMBL5767369 0.64 MMP12 (0.36) MAPTALOX5ALDH1A1
SCHEMBL5260689 0.61 HPGD (0.39) MAPTALOX5ALDH1A1HPGD
SCHEMBL5767136 0.60 PTPN1 (0.33) MAPT
SCHEMBL24839766 0.58 ALOX5 (0.31) ALOX5

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006525329-A 2006-11-09 JP claimed
EP-1620420-A2 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP claimed
WO-2004099168-A2 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO claimed
EP-1620420-A2 SUBSTITUTED CARBOXYLIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2006-02-01 EP disclosed
WO-2004099168-A2 SUBSTITUTED CARBOXYLIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2004-11-18 WO disclosed