SCHEMBL3259476

SCHEMBL3259476

C=CCc1cccc2c1C(=O)N(N)C2=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
AKR1B1 P15121 1/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C9 P11712 1/20 0.40
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
ALOX12 P18054 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
ELANE P08246 1/20 0.36
MPO P05164 1/20 0.36
ALDH1A1 P00352 2/20 0.36
CASP3 P42574 1/20 0.35
ANPEP P15144 1/20 0.34

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
SCHEMBL461208 0.81 GABRA1 (0.46) GABRA1GABRB2AKR1B1KDM4ELMNA
SCHEMBL4380150 0.81 TYMS (0.49) GABRA1GABRB2AKR1B1KDM4ELMNA
SCHEMBL11498102 0.81 GABRA1 (0.50) GABRA1GABRB2AKR1B1KDM4ELMNA
SCHEMBL10582948 0.79 CASP3 (0.55) GABRA1GABRB2AKR1B1KDM4ELMNA
SCHEMBL4379341 0.78 CYP1B1 (0.49) GABRA1GABRB2AKR1B1KDM4ELMNA
SCHEMBL31647607 0.75 DPP4 (0.41) KDM4EELANEMPOANPEPDPP4
SCHEMBL32669020 0.74 TYMS (0.35) MPOANPEPDPP4TYMS
SCHEMBL5824091 0.72 GABRA1 (0.58) GABRA1GABRB2AKR1B1KDM4ELMNA
SCHEMBL32668961 0.72 NR1H2 (0.36) KDM4EALOX15MPOANPEPDPP4
SCHEMBL175397 0.71 GABRA1 (0.50) GABRA1GABRB2AKR1B1KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678850-B2 Pigment dispersions containing aminated acrylic macromonomer dispersant E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-03-16 US claimed
US-20090012231-A1 PIGMENT DISPERSIONS CONTAINING AMINATED ACRYLIC MACROMONOMER DISPERSANT E. I. DU PONT DE NEMOURS AND COMPANY 2009-01-08 US claimed
US-20070142546-A1 Pigment dispersions containing aminated acrylic macromonomer dispersant AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2007-06-21 US claimed
US-7678850-B2 Pigment dispersions containing aminated acrylic macromonomer dispersant E.I. DU PONT DE NEMOURS AND COMPANY (US) 2010-03-16 US disclosed
US-20090012231-A1 PIGMENT DISPERSIONS CONTAINING AMINATED ACRYLIC MACROMONOMER DISPERSANT E. I. DU PONT DE NEMOURS AND COMPANY 2009-01-08 US disclosed
EP-1966335-A2 PIGMENT DISPERSIONS CONTAINING AMINATED ACRYLIC MACROMONOMER DISPERSANT E.I. DU PONT DE NEMOURS AND COMPANY (US) 2008-09-10 EP disclosed
WO-2007070724-A2 PIGMENT DISPERSIONS CONTAINING AMINATED ACRYLIC MACROMONOMER DISPERSANT E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-06-21 WO disclosed
US-20070142546-A1 Pigment dispersions containing aminated acrylic macromonomer dispersant AXALTA COATING SYSTEMS IP CO. LLC (FORMERLY KNOWN AS U.S. COATINGS IP CO. LLC) 2007-06-21 US disclosed