SCHEMBL431340

SCHEMBL431340

O=C(O)Oc1cn(Cc2ccccc2)cc1OC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.47
ALDH1A1 P00352 2/20 0.40
LMNA P02545 3/20 0.40
F2 P00734 1/20 0.39
PLG P00747 1/20 0.39
ELANE P08246 1/20 0.39
CTSG P08311 1/20 0.39
CMA1 P23946 1/20 0.39
CTRC Q99895 1/20 0.39
KDM5A P29375 1/20 0.39
KDM4C Q9H3R0 1/20 0.39
KDM5B Q9UGL1 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
POLB P06746 3/20 0.38
KMT2A Q03164 2/20 0.38
CYP2D6 P10635 2/20 0.38
MEN1 O00255 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38

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
SCHEMBL13357769 0.75 SIGMAR1 (0.46) POLBKMT2ACYP2D6MEN1CYP1A2
SCHEMBL353268 0.75 NOTUM (0.51) CYP2C19ALDH1A1LMNAF2PLG
SCHEMBL3973716 0.74 LMNA (0.44) LMNAELANETSHR
SCHEMBL9030278 0.74 LMNA (0.61) CYP2C19ALDH1A1LMNASMN1; SMN2POLB
SCHEMBL28771070 0.70 LMNA (0.58) CYP2C19LMNA
SCHEMBL143632 0.70 KDM4E (0.46) ALDH1A1LMNAF2TSHRSMN1; SMN2
SCHEMBL9022238 0.69 ADRA1D (0.50) ALDH1A1LMNATSHRSMN1; SMN2POLB
SCHEMBL28771055 0.68 KDM4E (0.59) ALDH1A1LMNASMN1; SMN2KMT2AMEN1
SCHEMBL5478147 0.68 HPGD (0.50) LMNATSHRSMN1; SMN2CYP1A2CYP3A4
SCHEMBL733739 0.68 ALPG (0.54) MAPT

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 69 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-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-2798013-A1 ANTI-REFLECTIVE COATING Leibniz-Institut für Neue Materialien gemeinnützige GmbH (DE) 2014-11-05 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-2408684-B1 BIOLOGICALLY DEGRADABLE MATERIAL BASED ON A POLYMERIC MATERIAL CONTAINING POROUS ORGANOMETALLIC NETWORKS BASF SE (DE) 2013-08-21 EP disclosed
WO-2013098090-A1 ANTI-REFLECTIVE COATING LEIBNIZ-INSTITUT FÜR NEUE MATERIALIEN GEMEINNÜTZIGE GMBH (DE) 2013-07-04 WO disclosed
WO-2007090864-A1 PROCESS FOR PREPARING POROUS ORGANIC FRAMEWORK MATERIALS BASF SE (DE) 2007-08-16 WO disclosed
WO-2007068681-A1 ACID-FUNCTIONALIZED ORGANOMETALLIC FRAMEWORK MATERIALS BASF SE (DE) 2007-06-21 WO disclosed
WO-2007057391-A1 ORGANOMETALLIC FRAMEWORK MATERIALS OF TRANSITION GROUP III BASF SE (DE) 2007-05-24 WO disclosed
WO-2007054581-A2 POROUS ORGANO-METALLIC SKELETON MATERIAL CONTAINING AN ADDITIONAL POLYMER BASF SE (DE) 2007-05-18 WO disclosed
EP-1785428-A1 Doped metal organic framework materials BASF AKTIENGESELLSCHAFT (DE) 2007-05-16 EP disclosed
WO-2007023134-A1 METHOD FOR PRODUCING ORGANOMETALLIC FRAMEWORK MATERIALS CONTAINING MAIN GROUP METAL IONS BASF AKTIENGESELLSCHAFT (DE) 2007-03-01 WO disclosed
WO-2006125761-A2 METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 WO disclosed
WO-2006122920-A1 GAS ODOROUS SUBSTANCE SEPARATION BASF AKTIENGESELLSCHAFT (DE) 2006-11-23 WO disclosed
EP-1702925-A1 absorption of liquids by metal organic framework materials BASF AKTIENGESELLSCHAFT (DE) 2006-09-20 EP disclosed
EP-1674555-A1 Concentration of methane in methane containing gas mixtures by adsorption BASF AKTIENGESELLSCHAFT (DE) 2006-06-28 EP disclosed