SCHEMBL9852706

SCHEMBL9852706

O=C(CCO)OC12CC3CC(CC(C3)C1)C2

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 5/20 0.51
CYP19A1 P11511 2/20 0.49
CYP17A1 P05093 1/20 0.44
NPSR1 Q6W5P4 3/20 0.42
TSHR P16473 1/20 0.42
NAAA Q02083 1/20 0.36
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.34
HSD11B1 P28845 1/20 0.34
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL18098114 0.85 EPHX2 (0.61) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL9917016 0.83 CYP19A1 (0.56) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL12936719 0.82 EPHX2 (0.50) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL18923150 0.82 EPHX2 (0.50) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL9619394 0.82 EPHX2 (0.50) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL27436848 0.81 CYP19A1 (0.53) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL24361870 0.79 EPHX2 (0.48) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL15449243 0.79 EPHX2 (0.55) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL12936716 0.79 EPHX2 (0.55) EPHX2CYP19A1CYP17A1NPSR1TSHR
SCHEMBL21968037 0.78 EPHX2 (0.50) EPHX2CYP19A1CYP17A1NPSR1TSHR

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
US-8147921-B2 Ink set for inkjet recording and inkjet recording method FUJIFILM CORPORATION (JP) 2012-04-03 US disclosed
US-8053169-B2 an N-vinylcaptrolactam; a polymerization initiator; and organic amine compounds as light stabilizers; curing FUJIFILM CORPORATION (JP) 2011-11-08 US disclosed
US-20100075119-A1 INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed
US-7553605-B2 Ink composition, inkjet recording method, printed material, and process for producing lithographic printing plate FUJIFILM CORPORATION (JP) 2009-06-30 US disclosed
US-20090087627-A1 WHITE INK COMPOSITION, INKJET RECORDING METHOD, AND PRINTED MATERIAL FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20090085256-A1 IMAGE FORMING METHOD AND APPARATUS FUJIFILM CORPORATION (JP) 2009-04-02 US disclosed
US-20080239045-A1 INK SET FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2008-10-02 US disclosed
US-20080063981-A1 Ink composition, inkjet recording method, printed material, and process for producing lithographic printing plate FUJIFILM CORPORATION (JP) 2008-03-13 US disclosed
US-20080008966-A1 Ink composition, inkjet recording method, printed material, and process for producing lithographic printing plate FUJIFILM CORPORATION (JP) 2008-01-10 US disclosed
EP-0437016-A2 Lipid A analogues having immunoactivating and anti-tumour activity Sankyo Company Limited (JP) 1991-07-17 EP disclosed
EP-0363223-A2 3-Aryloxymethyl-cephalosporin derivatives, their preparation and their medical use Sankyo Company Limited (JP) 1990-04-11 EP disclosed