SCHEMBL1033745

SCHEMBL1033745

CCc1ccc(C(=O)OO)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.61
PLK1 P53350 1/20 0.55
TDP1 Q9NUW8 1/20 0.52
LMNA P02545 3/20 0.50
GAA P10253 2/20 0.50
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
POLB P06746 2/20 0.46
RAB9A P51151 2/20 0.46
MAPT P10636 1/20 0.46
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
ESR1 P03372 1/20 0.45

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
SCHEMBL775750 0.84 ALDH1A1 (0.64) ALDH1A1PLK1TDP1LMNARXRA
SCHEMBL36204 0.84 ALDH1A1 (0.64) ALDH1A1PLK1TDP1LMNARXRA
SCHEMBL1286650 0.83 CES2 (0.48) ALDH1A1TDP1LMNARAB9AMAPT
SCHEMBL7560761 0.82 RARB (0.59) ALDH1A1PLK1MAPTMEN1KMT2A
SCHEMBL131711 0.82 LOXL2 (0.70) ALDH1A1PLK1TDP1LOXL2SMN1; SMN2
SCHEMBL28548027 0.80 ALDH1A1 (0.59) ALDH1A1PLK1TDP1LMNARXRA
SCHEMBL28800124 0.80 LOXL2 (0.68) ALDH1A1PLK1TDP1LOXL2SMN1; SMN2
SCHEMBL12814190 0.80 ALDH1A1 (0.59) ALDH1A1PLK1TDP1LMNARXRA
SCHEMBL128190 0.80 CA1 (0.70) ALDH1A1PLK1TDP1LMNASMN1; SMN2
SCHEMBL8174462 0.80 ALDH1A1 (0.59) ALDH1A1PLK1TDP1LMNAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2396350-B1 METHOD FOR SYNTHESIZING IMPROVED BINDERS HAVING A DEFINED GRAIN SIZE DISTRIBUTION EVONIK ROEHM GMBH (DE) 2014-03-12 EP disclosed
EP-2451640-B1 HALOGEN FREE HOT SEALING COMPOSITION FOR ALUMINIUM FOILS TOWARDS CONTAINERS MADE OF POLYVINYLCHLORIDE AND POLYSTYRENE EVONIK ROEHM GMBH (DE) 2013-05-01 EP disclosed
EP-2501725-A1 MASS POLYMERIZATION OF (METH)ACRYLATE CO-POLYMERS WHICH ARE SOLUBLE IN AQUEOUS ALKALINE Evonik Röhm GmbH (DE) 2012-09-26 EP disclosed
WO-2011061004-A1 MASS POLYMERIZATION OF (METH)ACRYLATE CO-POLYMERS WHICH ARE SOLUBLE IN AQUEOUS ALKALINE EVONIK RÖHM GMBH (DE) 2011-05-26 WO disclosed
EP-2276817-A1 SYNTHESIS OF IMPROVED BINDERS AND MODIFIED TACTICITY Evonik Röhm GmbH (DE) 2011-01-26 EP disclosed
WO-2009121640-A1 SYNTHESIS OF IMPROVED BINDERS AND MODIFIED TACTICITY EVONIK RÖHM GMBH (DE) 2009-10-08 WO disclosed
US-5808114-A EPOXIDATION; REMOVING AROMATIC CARBOXYLIC ACID; CATALYTIC HYDROGENATION TO ALDEHYDE; OXIDATION; CIRCULATION; REUSE; FREE OF HYDROGEN PEROXIDE BASF AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed
EP-0811003-B1 PROCESS FOR PRODUCING EPOXIDES USING AROMATIC PEROXYCARBOXYLIC ACIDS BASF AG (DE) 1998-09-02 EP disclosed
CN-1175949-A Process for producing eposides using aromatic peroxycarboxylic acids BASF AG (DE) 1998-03-11 CN disclosed
EP-0811003-A1 PROCESS FOR PRODUCING EPOXIDES USING AROMATIC PEROXYCARBOXYLIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1997-12-10 EP disclosed
WO-1996026198-A1 PROCESS FOR PRODUCING EPOXIDES USING AROMATIC PEROXYCARBOXYLIC ACIDS BASF AKTIENGESELLSCHAFT (DE) 1996-08-29 WO disclosed