SCHEMBL376800

SCHEMBL376800

Nc1ccc(-c2ccc(N)c(OC(=O)O)c2)cc1OC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
TDP1 Q9NUW8 5/20 0.52
HSD17B10 Q99714 4/20 0.52
CYP3A4 P08684 4/20 0.52
TSHR P16473 3/20 0.52
KMT2A Q03164 6/20 0.50
KDM4E B2RXH2 4/20 0.50
GFER P55789 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
MEN1 O00255 5/20 0.47
MAPT P10636 4/20 0.47
POLB P06746 3/20 0.47
MAPK1 P28482 2/20 0.47
HPGD P15428 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
IKBKB O14920 1/20 0.43
ALOX15 P16050 2/20 0.41
CFD P00746 1/20 0.39
HDAC2 Q92769 3/20 0.39
HDAC3 O15379 2/20 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
SCHEMBL1954453 1.00 ALDH1A1 (0.52) ALDH1A1TDP1HSD17B10CYP3A4TSHR
SCHEMBL9635994 0.83 ALDH1A1 (0.52) ALDH1A1TDP1HSD17B10CYP3A4TSHR
SCHEMBL7754586 0.83 MAPT (0.48) ALDH1A1TDP1HSD17B10CYP3A4TSHR
SCHEMBL1551903 0.82 KDM4E (0.44) ALDH1A1TDP1CYP3A4KMT2AKDM4E
SCHEMBL8681017 0.82 ALDH1A1 (0.55) ALDH1A1TDP1HSD17B10CYP3A4TSHR
SCHEMBL686628 0.80 CFD (0.47) ALDH1A1HSD17B10CYP3A4TSHRKMT2A
SCHEMBL13929946 0.80 TPMT (0.34) ALDH1A1TDP1HSD17B10CYP3A4TSHR
Acetamide SCHEMBL5081796 0.79 ALDH1A1 (0.52) ALDH1A1TDP1HSD17B10CYP3A4TSHR
SCHEMBL9370523 0.79 ALDH1A1 (0.57) ALDH1A1TDP1HSD17B10CYP3A4TSHR
SCHEMBL4650355 0.79 ALDH1A1 (0.56) ALDH1A1TDP1HSD17B10CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739169-B1 POROUS CATALYTIC MATRICES FOR ELIMINATION OF TOXICANTS FOUND IN TOBACCO COMBUSTION PRODUCTS MASSACHUSETTS INST TECHNOLOGY (US) 2019-06-12 EP claimed
EP-1799791-B1 PHOTOCROSSLINKABLE MATERIALS ROLIC AG (CH) 2016-01-13 EP claimed
EP-2332529-A1 Substituted aromatic diamines as ligands of vesicular glutamate transporter 1 and 2 (vGLUT1 and vGLUT2) Grünenthal GmbH (DE) 2011-06-15 EP claimed
EP-0303069-B1 PROCESS FOR THE PREPARATION OF OLIGOMERIC OR POLYMERIC RADIATION-REACTIVE PREADDUCTS FOR SOLVENT-STRUCTURED COATINGS BASF Aktiengesellschaft (DE) 1992-06-24 EP claimed
EP-0157930-B1 PROCESS FOR THE PREPARATION OF POLYIMIDE AND POLYISOINDOLO-QUINAZOLINE DIONE RELIEF STRUCTURES SIEMENS AKTIENGESELLSCHAFT (DE) 1988-03-23 EP claimed
EP-0027506-B1 PRECURSORS OF POLYIMIDES, POLYISOINDOLOQUINAZOLINE DIONES, POLYOXAZINE DIONES AND POLYQUINAZOLINE DIONES, THEIR PREPARATION AND USE SIEMENS AKTIENGESELLSCHAFT (DE) 1983-05-11 EP claimed
EP-0027506-A1 Precursors of polyimides, polyisoindoloquinazoline diones, polyoxazine diones and polyquinazoline diones, their preparation and use SIEMENS AKTIENGESELLSCHAFT (DE) 1981-04-29 EP claimed
EP-1687462-B1 METHOD FOR ELECTROCHEMICAL PRODUCTION OF A CRYSTALLINE POROUS METAL ORGANIC SKELETON MATERIAL FRAUNHOFER GES FORSCHUNG (DE) 2019-03-13 EP disclosed
EP-2798013-B1 ANTI-REFLECTIVE COATING LEIBNIZ INST FÜR NEUE MATERIALIEN GEMEINNÜTZIGE GMBH (DE) 2016-08-17 EP disclosed
EP-2168971-B1 Fluid absorption by metal-organic frameworks BASF SE (DE) 2016-08-03 EP disclosed
EP-2230288-B1 METAL-ORGANIC FRAMEWORKS IN REFRIGERATION/HEATING MACHINES BASF SE (DE) 2016-05-25 EP disclosed
EP-2408536-B1 PROCESS FOR SEPARATING ACID GASES USING AMINE IMPREGNATED METAL ORGANIC FRAMEWORKS BASF SE (DE) 2014-07-30 EP disclosed
EP-2117676-B1 METHOD FOR SEPARATING GASES USING A POROUS METAL ORGANIC FRAMEWORK MATERIAL BASF SE (DE) 2014-06-25 EP disclosed
EP-0088930-B1 TRIAZOLE-TRIAZINYL AZO DYES BAYER AG (DE) 1986-04-09 EP disclosed
EP-0159292-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1985-10-23 EP disclosed
EP-0144766-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1985-06-19 EP disclosed
EP-0107621-A2 Composition suitable for obtaining positive images, process for obtaining positive images and images obtained using the same CIBA-GEIGY AG (CH) 1984-05-02 EP disclosed
EP-0088930-A2 Triazole-triazinyl azo dyes BAYER AG (DE) 1983-09-21 EP disclosed
EP-0027506-B1 PRECURSORS OF POLYIMIDES, POLYISOINDOLOQUINAZOLINE DIONES, POLYOXAZINE DIONES AND POLYQUINAZOLINE DIONES, THEIR PREPARATION AND USE SIEMENS AKTIENGESELLSCHAFT (DE) 1983-05-11 EP disclosed
EP-0027506-A1 Precursors of polyimides, polyisoindoloquinazoline diones, polyoxazine diones and polyquinazoline diones, their preparation and use SIEMENS AKTIENGESELLSCHAFT (DE) 1981-04-29 EP disclosed