SCHEMBL377288

SCHEMBL377288

Cc1cnc2c(OC(=O)O)c(Cl)c(OC(=O)O)cc2c1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 2/20 0.38
CCR5 P51681 2/20 0.38
CCR8 P51685 2/20 0.38
PARP1 P09874 1/20 0.37
KDM4E B2RXH2 4/20 0.35
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
PSMD14 O00487 1/20 0.32
COPS5 Q92905 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C9 P11712 1/20 0.32
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 1/20 0.31
HSD17B10 Q99714 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KMT2A Q03164 1/20 0.31
RXFP1 Q9HBX9 1/20 0.31
SLC40A1 Q9NP59 1/20 0.30

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
SCHEMBL985744 0.79 CCR1 (0.50) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL10920276 0.72 KDM4E (0.44) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL9358679 0.72 PARP1 (0.56) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL10920918 0.70 KDM4E (0.48) CCR1CCR5CCR8KDM4EPKM
SCHEMBL3837299 0.67 SLC13A5 (0.37) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL29450081 0.67 PARP1 (0.42) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL352741 0.67 PARP1 (0.42) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL9862013 0.66 SSTR4 (0.41) KDM4ECYP2C9ALDH1A1NPC1RAB9A
SCHEMBL10756613 0.66 CCR1 (0.47) CCR1CCR5CCR8PARP1KDM4E
SCHEMBL13040596 0.65 CCR1 (0.36) CCR1CCR5CCR8PARP1KDM4E

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 53 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-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
EP-2408536-A1 METHOD FOR SEPARATING ACID GASES USING METAL-ORGANIC FRAMEWORKS IMPREGNATED WITH AMINES BASF SE (DE) 2012-01-25 EP disclosed
WO-2007131948-A2 PROCESS FOR PREPARING POROUS METAL ORGANIC FRAMEWORKS BASF SE (DE) 2007-11-22 WO disclosed
WO-2007118888-A1 METHODS FOR PRODUCING METAL-ORGANIC FRAMEWORK MATERIALS CONTAINING METALS OF SUBGROUP IV BASF SE (DE) 2007-10-25 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-2006125761-A2 METHOD FOR PRODUCING POROUS METAL-ORGANIC FRAMEWORK MATERIALS BASF AKTIENGESELLSCHAFT (DE) 2006-11-30 WO disclosed
EP-1687462-A1 METHOD FOR ELECTROCHEMICAL PRODUCTION OF A CRYSTALLINE POROUS METAL ORGANIC SKELETON MATERIAL BASF AKTIENGESELLSCHAFT (DE) 2006-08-09 EP disclosed
WO-2005049892-A1 METHOD FOR ELECTROCHEMICAL PRODUCTION OF A CRYSTALLINE POROUS METAL ORGANIC SKELETON MATERIAL BASF AKTIENGESELLSCHAFT (DE) 2005-06-02 WO disclosed