SCHEMBL2019808

SCHEMBL2019808

CC1CCC(c2ccccc2)(c2ccccc2)CC1C

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
OPRM1 P35372 2/20 0.41
DRD4 P21917 1/20 0.40

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
SCHEMBL2044939 0.81 ESR2 (0.49) OPRM1
SCHEMBL8101425 0.77 OPRM1 (0.50) MAPK1SMN1; SMN2OPRM1DRD4
SCHEMBL9858405 0.74
SCHEMBL11572399 0.73 OPRL1 (0.52) MAPK1SMN1; SMN2OPRM1DRD4
SCHEMBL11766751 0.73 HTR2A (0.45) MAPK1SMN1; SMN2OPRM1DRD4
SCHEMBL11763463 0.73 MAPK1 (0.44) MAPK1SMN1; SMN2OPRM1DRD4
SCHEMBL9065813 0.73 ESR2 (0.42) MAPK1SMN1; SMN2
Hydrochloric Acid SCHEMBL11569798 0.72 OPRL1 (0.50) MAPK1SMN1; SMN2
SCHEMBL9066385 0.71 ACHE (0.53) OPRM1
SCHEMBL3359965 0.70 MAPK1 (0.33) MAPK1SMN1; SMN2

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 24 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101309753-B Carbonylation of ethylenically unsaturated compounds LUCITE INT UK LTD 2013-01-30 CN claimed
CN-101309753-A Carbonylation of ethylenically unsaturated compounds LUCITE INT UK LTD (GB) 2008-11-19 CN claimed
EP-1957198-A1 CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS Lucite International UK Limited (GB) 2008-08-20 EP claimed
WO-2007057640-A1 CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS LUCITE INTERNATIONAL UK LIMITED (GB) 2007-05-24 WO claimed
EP-2794548-B1 A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE LUCITE INT UK LTD (GB) 2019-05-15 EP 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
US-8445711-B2 Metal complexes LUCITE INTERNATIONAL UK LIMITED (GB) 2013-05-21 US disclosed
CN-101309753-B Carbonylation of ethylenically unsaturated compounds LUCITE INT UK LTD 2013-01-30 CN disclosed
US-20120309613-A1 CARBONYLATION PROCESS LUCITE INTERNATIONAL UK LIMITED (GB) 2012-12-06 US disclosed
EP-2513031-A1 A CONTINUOUS PROCESS FOR THE CARBONYLATION OF ETHYLENE Lucite International UK Limited (GB) 2012-10-24 EP disclosed
CN-102740972-A Improved carbonylation process LUCITE INT UK LTD 2012-10-17 CN disclosed
US-20100022799-A1 CARBONYLATION OF CONJUGATED DIENES LUCITE INTERNATIONAL UK LIMITED (GB) 2010-01-28 US disclosed
US-20090312561-A1 METAL COMPLEXES LUCITE INTERNATIONAL UK LIMITED (GB) 2009-12-17 US 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
CN-101309753-A Carbonylation of ethylenically unsaturated compounds LUCITE INT UK LTD (GB) 2008-11-19 CN disclosed
EP-1957198-A1 CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS Lucite International UK Limited (GB) 2008-08-20 EP disclosed
WO-2008075108-A1 CARBONYLATION OF CONJUGATED DIENES LUCITE INTERNATIONAL UK LIMITED (GB) 2008-06-26 WO disclosed
WO-2007057640-A1 CARBONYLATION OF ETHYLENICALLY UNSATURATED COMPOUNDS LUCITE INTERNATIONAL UK LIMITED (GB) 2007-05-24 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100022799-A1 CARBONYLATION OF CONJUGATED DIENES CBR3, CBR1, CA5B MAPK1 1670/4885SMN1; SMN2 2256/4885OPRM1 2383/4885
US-20090312561-A1 METAL COMPLEXES MLX, PICALM, AP2M1 MAPK1 2355/4885SMN1; SMN2 2999/4885OPRM1 30/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.