SCHEMBL7707716

SCHEMBL7707716

CC(=O)Oc1cccc2[nH]nnc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.44
MAPK1 P28482 2/20 0.41
PTGS2 P35354 7/20 0.41
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 4/20 0.41
TDP1 Q9NUW8 3/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 2/20 0.41
BLM P54132 2/20 0.41
ESR1 P03372 1/20 0.41
ITGB3 P05106 1/20 0.41
ITGA2B P08514 1/20 0.41
HMGB1 P09429 1/20 0.41
TSHR P16473 1/20 0.41
GGT1 P19440 1/20 0.41
PTGS1 P23219 1/20 0.41
NAPRT Q6XQN6 1/20 0.41
ACHE P22303 1/20 0.41
PDE5A O76074 1/20 0.40
CYP3A4 P08684 1/20 0.39

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
SCHEMBL44289 0.87 MAPT (0.33) KDM4EHPGDHSD17B10LMNAMAPT
SCHEMBL8844752 0.87 MAPT (0.33) KDM4ETDP1PDE5ALMNAMAPT
SCHEMBL818765 0.86 ELANE (0.37) SLC22A6TDP1PDE5AKMT2AMAPT
SCHEMBL44290 0.85 LMNA (0.35) KDM4EALDH1A1TDP1LMNAKMT2A
SCHEMBL2534586 0.84 MEN1 (0.38) KDM4ELMNAKMT2AMEN1MAPT
SCHEMBL14690221 0.84 MAPT (0.32) KDM4ELMNAMAPTPOLB
SCHEMBL30442196 0.83 ACHE (0.39) KDM4EALDH1A1TDP1ESR1ACHE
SCHEMBL27464332 0.83 ATM (0.34) TDP1LMNAKMT2AMEN1HTT
Ethylene Glycol SCHEMBL4451270 0.81 MAPT (0.31) LMNAMAPT
SCHEMBL2849876 0.81 KDM4E (0.37) SLC22A6KDM4EALDH1A1TDP1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6358904-B1 ENZYMATIC OXIDATION CATALYSTS AND OXIDIZING AGENT COMPRISING AIR, OXYGEN, HYDROGEN PEROXIDE, SODIUM PERBORATE, SODIUM PERCARBONATE OR ORGANIC PEROXIDE; HYDROXY- OR ACETOXYBENZOTRIAZOLE MEDIATOR; ANTISOILANTS BAYER AG (DE) 2002-03-19 US claimed
US-6358904-B1 ENZYMATIC OXIDATION CATALYSTS AND OXIDIZING AGENT COMPRISING AIR, OXYGEN, HYDROGEN PEROXIDE, SODIUM PERBORATE, SODIUM PERCARBONATE OR ORGANIC PEROXIDE; HYDROXY- OR ACETOXYBENZOTRIAZOLE MEDIATOR; ANTISOILANTS BAYER AG (DE) 2002-03-19 US disclosed
EP-0705327-B1 MULTICOMPONENT BLEACHING SYSTEM CALL HANS PETER (DE) 2000-04-19 EP disclosed
EP-0983334-A1 ENZYMATIC BLEACHING SYSTEM CONTAINING NEW COMPOUNDS FOR INTENSIFYING ENZYMATIC ACTION Call, Krimhild (DE) 2000-03-08 EP disclosed
WO-1998051772-A1 ENZYMATIC BLEACHING SYSTEM CONTAINING NEW COMPOUNDS FOR INTENSIFYING ENZYMATIC ACTION CALL, KRIMHILD (DE) 1998-11-19 WO disclosed
EP-0845026-A1 MULTICOMPONENT SYSTEM FOR USE WITH DETERGENT SUBSTANCES CALL, Hans-Peter Dr. (DE) 1998-06-03 EP disclosed
WO-1997048786-A1 MULTICOMPONENT SYSTEM FOR USE WITH DETERGENT SUBSTANCES CALL HANS PETER (DE) 1997-12-24 WO disclosed
EP-0705327-A1 MULTICOMPONENT BLEACHING SYSTEM CALL, Hans-Peter Dr. (DE) 1996-04-10 EP disclosed
WO-1994029425-A2 MULTICOMPONENT BLEACHING SYSTEM CALL HANS PETER (DE) 1994-12-22 WO disclosed