SCHEMBL458659

SCHEMBL458659

CN(C)c1c(C(=O)O)cccc1C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
ALOX15 P16050 2/20 0.52
KDM4E B2RXH2 2/20 0.48
HPGD P15428 2/20 0.48
HSD17B10 Q99714 2/20 0.48
TSHR P16473 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 2/20 0.45
NR4A1 P22736 1/20 0.45
NR4A2 P43354 1/20 0.45
NR4A3 Q92570 1/20 0.45
TP53 P04637 1/20 0.45
GAA P10253 1/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA4 P22748 2/20 0.44
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
NAPRT Q6XQN6 2/20 0.44

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
SCHEMBL29579190 0.92 ALDH1A1 (0.53) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL16835572 0.92 ALDH1A1 (0.53) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL6646719 0.87 ALDH1A1 (0.57) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL10455717 0.87 MMP2 (0.57) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL28137440 0.87 TSHR (0.47) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL17202120 0.87 AKR1C3 (0.60) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL6831109 0.86 TSHR (0.57) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL29475660 0.86 ALB (0.55) ALDH1A1ALOX15KDM4EHPGDHSD17B10
SCHEMBL16534340 0.86 MAPT (0.55) ALDH1A1ALOX15KDM4EHPGDHSD17B10
Ethylene Glycol SCHEMBL28432885 0.85 ALDH1A1 (0.47) ALDH1A1ALOX15KDM4EHPGDHSD17B10

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 73 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3850698-A2 LOW PERMEABILITY POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES University of South Carolina (US) 2021-07-21 EP claimed
EP-3850697-A1 POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES University of South Carolina (US) 2021-07-21 EP claimed
WO-2020056275-A1 POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES UNIVERSITY OF SOUTH CAROLINA (US) 2020-03-19 WO claimed
WO-2020056268-A2 LOW PERMEABILITY POLYBENZIMIDAZOLE (PBI) MEMBRANES FOR REDOX FLOW BATTERIES UNIVERSITY OF SOUTH CAROLINA (US) 2020-03-19 WO claimed
EP-2804889-A1 PROTON-CONDUCTING MEMBRANE, METHOD FOR THEIR PRODUCTION AND THEIR USE IN ELECTROCHEMICAL CELLS BASF SE (DE) 2014-11-26 EP claimed
EP-2804888-A1 PROTON-CONDUCTING MEMBRANE, METHOD FOR THEIR PRODUCTION AND THEIR USE IN ELECTROCHEMICAL CELLS BASF SE (DE) 2014-11-26 EP claimed
WO-2013108111-A1 PROTON-CONDUCTING MEMBRANE, METHOD FOR THEIR PRODUCTION AND THEIR USE IN ELECTROCHEMICAL CELLS BASF SE (DE) 2013-07-25 WO claimed
WO-2013108112-A1 PROTON-CONDUCTING MEMBRANE, METHOD FOR THEIR PRODUCTION AND THEIR USE IN ELECTROCHEMICAL CELLS BASF SE (DE) 2013-07-25 WO claimed
WO-2012153172-A1 MECHANICALLY STABILIZED POLYAZOLES CONTAING AT LEAST ONE POLYVINYL ALCOHOL BASF SE (DE) 2012-11-15 WO disclosed
WO-2012102923-A2 POROUS POLYBENZIMIDAZOLE RESIN AND METHOD OF MAKING SAME PBI PERFOMANCE PRODUCTS, INC. (US) 2012-08-02 WO disclosed
WO-2012087442-A1 POLYBENZIMIDAZOLE SOLUTION IN AN IONIC LIQUID PBI PERFORMANCE PRODUCTS, INC. (US) 2012-06-28 WO disclosed
WO-2012073084-A1 MEMBRANE-ELECTRODE UNIT AND FUEL CELLS WITH IMPROVED LIFETIME BASF SE (DE) 2012-06-07 WO disclosed
WO-2012073085-A1 MEMBRANE-ELECTRODE UNIT AND FUEL CELLS WITH IMPROVED LIFETIME BASF SE (DE) 2012-06-07 WO disclosed
EP-2443175-A2 COMPOSITION CONTAINING POLYAZOLE BASF SE (DE) 2012-04-25 EP disclosed
WO-2002088219-A1 PROTON-CONDUCTING MEMBRANE AND USE THEREOF CELANESE VENTURES GMBH (DE) 2002-11-07 WO disclosed
WO-2002081547-A1 PROTON-CONDUCTING MEMBRANE AND THE USE THEREOF CELANESE VENTURES GMBH (DE) 2002-10-17 WO disclosed
WO-2000044742-A1 IMPROVED SENSITIZERS FOR USE IN PHOTODYNAMIC THERAPY LAMBDA PHARMACEUTICALS, INC. (US) 2000-08-03 WO disclosed
WO-1995005403-A1 RADIATION CURABLE ALK-1-ENYL ETHER POLYESTER PREPOLYMERS ISP INVESTMENTS INC. (US) 1995-02-23 WO disclosed
US-5342860-A Unsaturated polyesters based on a alkenyloxy-substituted glycol and having alkenyloxy-substituted alcohol end groups; protective coatings; rapid cure at room temperature ISP INVESTMENTS INC. (US) 1994-08-30 US disclosed
US-4118439-A IONICALLY CROSSLINKED QUATERNARY AMMONIUM POLYMER RHONE-POULENC S.A. (FR) 1978-10-03 US disclosed