SCHEMBL1702938

SCHEMBL1702938

C=Cc1cccc(C(=O)OC2CC3CCC2C3)c1OC

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 5/20 0.43
RAB9A P51151 1/20 0.38
CYP19A1 P11511 1/20 0.38
ATM Q13315 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
PDE4A P27815 4/20 0.36
PDE4B Q07343 4/20 0.36
PDE4C Q08493 4/20 0.36
PDE4D Q08499 4/20 0.36
CNR2 P34972 1/20 0.34
SLC6A3 Q01959 1/20 0.34

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
SCHEMBL1397154 0.86 GRM1 (0.45) GRM1RAB9ACYP19A1ATMALDH1A1
SCHEMBL27834863 0.82 CNR2 (0.39) RAB9ACNR2
SCHEMBL27834857 0.77 MEN1 (0.44) RAB9AATM
SCHEMBL2949035 0.74 LMNA (0.44) ATMKDM4EALDH1A1MAPTNPSR1
SCHEMBL27834864 0.73 PTPN1 (0.37) KDM4EALDH1A1MAPTSLC6A3
SCHEMBL9402766 0.72 GRM1 (0.48) GRM1CYP19A1ATMALDH1A1PDE4A
SCHEMBL2196170 0.71 ATM (0.41) GRM1RAB9ACYP19A1ATMPDE4A
SCHEMBL7703171 0.71 CYP19A1 (0.54) GRM1RAB9ACYP19A1ATMPDE4A
SCHEMBL5468604 0.70 ALDH1A1 (0.44) RAB9AKDM4EALDH1A1MAPTMAPK1
SCHEMBL2409607 0.70 CA1 (0.37) KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2007834-B1 SULPHONIUM SALT INITIATORS BASF SE (DE) 2015-11-04 EP disclosed
EP-2197840-B1 SULPHONIUM SALT INITIATORS BASF SE (DE) 2013-11-06 EP disclosed
EP-2125713-B1 SULPHONIUM SALT PHOTOINITIATORS BASF SE (DE) 2012-04-18 EP disclosed
EP-2197839-A1 SULPHONIUM SALT INITIATORS BASF SE (DE) 2010-06-23 EP disclosed
EP-2197840-A1 SULPHONIUM SALT INITIATORS BASF SE (DE) 2010-06-23 EP disclosed
EP-2197869-A1 SULPHONIUM SALT INITIATORS BASF SE (DE) 2010-06-23 EP disclosed
EP-2125713-A1 SULPHONIUM SALT PHOTOINITIATORS Ciba SC Holding AG (CH) 2009-12-02 EP disclosed
WO-2009047151-A1 SULPHONIUM SALT INITIATORS BASF SE (CH) 2009-04-16 WO disclosed
WO-2009047152-A1 SULPHONIUM SALT INITIATORS BASF SE (CH) 2009-04-16 WO disclosed
WO-2009047105-A1 SULPHONIUM SALT INITIATORS BASF SE (CH) 2009-04-16 WO disclosed
EP-2007834-A1 SULPHONIUM SALT INITIATORS Ciba Holding Inc. (CH) 2008-12-31 EP disclosed
WO-2008040648-A1 SULPHONIUM SALT PHOTOINITIATORS CIBA HOLDING INC. (CH) 2008-04-10 WO disclosed
EP-1902019-A1 SULPHONIUM SALT INITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. Patent Departement (CH) 2008-03-26 EP disclosed
WO-2007118794-A1 SULPHONIUM SALT INITIATORS CIBA HOLDING INC. (CH) 2007-10-25 WO disclosed
WO-2007003507-A1 SULPHONIUM SALT INITIATORS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2007-01-11 WO disclosed
US-20010036591-A1 Iodonium salts as latent acid donors IGM GROUP B.V. (NL) 2001-11-01 US disclosed
US-6306555-B1 RADIATION-SENSITIVE COMPOSITION COMPRISING CATIONICALLY OR ACID-CATALYTICALLY POLYMERISABLE OR CROSSLINKABLE COMPOUND OR COMPOUND THAT INCREASES ITS SOLUBILITY IN DEVELOPER UNDER ACTION OF ACID, AND AT LEAST ONE DIARYLIODONIUM SALT CIBA SPECIALTY CHEMICALS CORP. 2001-10-23 US disclosed