SCHEMBL2011475

SCHEMBL2011475

c1ccc(-c2ccc(CP(C34CC5CC(CC(C5)C3)C4)C34CC5CC(CC(C5)C3)C4)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.39
TAAR1 Q96RJ0 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 2/20 0.36
CYP2D6 P10635 1/20 0.36
KDM1A O60341 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.36
TSHR P16473 3/20 0.36
OPRK1 P41145 1/20 0.36
CNR2 P34972 2/20 0.35
MAPK1 P28482 2/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EPHX2 P34913 1/20 0.35
P2RX7 Q99572 1/20 0.35
HSD11B1 P28845 1/20 0.35

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
SCHEMBL289717 0.90 OPRK1 (0.42) HPGDMEN1KMT2ARAB9AALDH1A1
SCHEMBL5738047 0.88 OPRK1 (0.41) HPGDMEN1KMT2ARAB9AALDH1A1
Bromide SCHEMBL1478373 0.88 OPRK1 (0.41) HPGDMEN1KMT2ARAB9AALDH1A1
SCHEMBL3677736 0.83 MEN1 (0.38) HPGDMEN1KMT2AMAPTCYP2D6
SCHEMBL3007963 0.81 CNR2 (0.39) MAPTALDH1A1POLBCNR2CNR1
SCHEMBL2015640 0.81 ALDH1A1 (0.39) HPGDMEN1KMT2ARAB9AKDM1A
SCHEMBL3005852 0.78 MEN1 (0.38) MEN1KMT2AMAPTNPSR1ALDH1A1
SCHEMBL1734830 0.77 P2RX7 (0.39) HPGDMEN1KMT2AALDH1A1TSHR
SCHEMBL2018311 0.75 MGAM (0.31) HPGDMEN1KMT2AALDH1A1CNR2
SCHEMBL2015150 0.75 MEN1 (0.40) MEN1KMT2AKDM1APOLBTSHR

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
CN-106928061-B Continuous process for the carbonylation of ethylene 璐彩特国际英国有限公司 2020-08-28 CN claimed
EP-2167232-A1 A PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM Lucite International UK Limited (GB) 2010-03-31 EP claimed
WO-2009010782-A1 A PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM LUCITE INTERNATIONAL UK LIMITED (GB) 2009-01-22 WO claimed
EP-2007703-A1 METAL COMPLEXES FOR USE IN THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS Lucite International UK Limited (GB) 2008-12-31 EP claimed
WO-2007119079-A1 METAL COMPLEXES FOR USE IN THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS LUCITE INTERNATIONAL UK LIMITED (GB) 2007-10-25 WO claimed
CN-106928061-B Continuous process for the carbonylation of ethylene 璐彩特国际英国有限公司 2020-08-28 CN disclosed
CN-105153241-B Carbonylation ligands and their use in the carbonylation of ethylenically unsaturated compounds 卢西特国际英国有限公司 2020-05-15 CN disclosed
EP-2794548-A1 A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE Lucite International UK Limited (GB) 2014-10-29 EP disclosed
WO-2013093472-A1 A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE LUCITE INTERNATIONAL UK LIMITED (GB) 2013-06-27 WO disclosed
EP-2512670-A1 IMPROVED CARBONYLATION PROCESS Lucite International UK Limited (GB) 2012-10-24 EP disclosed
WO-2011073653-A1 IMPROVED CARBONYLATION PROCESS LUCITE INTERNATIONAL UK LIMITED (GB) 2011-06-23 WO disclosed
EP-2167232-A1 A PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM Lucite International UK Limited (GB) 2010-03-31 EP disclosed
EP-2094635-A1 CARBONYLATION OF CONJUGATED DIENES Lucite International UK Limited (GB) 2009-09-02 EP disclosed
WO-2009010782-A1 A PROCESS FOR THE CARBONYLATION OF AN ETHYLENICALLY UNSATURATED COMPOUND AND A CATALYST SYSTEM LUCITE INTERNATIONAL UK LIMITED (GB) 2009-01-22 WO disclosed
EP-2007703-A1 METAL COMPLEXES FOR USE IN THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS Lucite International UK Limited (GB) 2008-12-31 EP disclosed
WO-2008075108-A1 CARBONYLATION OF CONJUGATED DIENES LUCITE INTERNATIONAL UK LIMITED (GB) 2008-06-26 WO disclosed
WO-2007119079-A1 METAL COMPLEXES FOR USE IN THE CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS LUCITE INTERNATIONAL UK LIMITED (GB) 2007-10-25 WO disclosed