SCHEMBL4067305

SCHEMBL4067305

CC(C)(C)C1C2CC3CC(C2)CC1C3

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.38
EPHX2 P34913 1/20 0.35
EPHX1 P07099 1/20 0.31

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
SCHEMBL701612 0.80
SCHEMBL6456147 0.77 CYP2C9 (0.41) CYP2C9EPHX2EPHX1
SCHEMBL22073526 0.77 CYP2C9 (0.35) CYP2C9EPHX2
SCHEMBL3282039 0.77 CYP2C9 (0.35) CYP2C9EPHX2
SCHEMBL18638965 0.75 CYP2C9 (0.39) CYP2C9EPHX2
SCHEMBL24433541 0.73 EPHX2 (0.35) CYP2C9EPHX2EPHX1
SCHEMBL13085357 0.73
SCHEMBL12193712 0.69 CYP2C9 (0.35) CYP2C9EPHX2
SCHEMBL4412291 0.69 CYP2C9 (0.45) CYP2C9EPHX2
SCHEMBL6346244 0.66 CYP2C9 (0.36) CYP2C9EPHX2EPHX1

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-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-01 US disclosed
EP-1554039-B1 A CATALYST SYSTEM COMPRISING A 1,2-BIS-(PHOSPHINO)METALLOCENE LIGAND LUCITE INT UK LTD (GB) 2013-07-03 EP disclosed
EP-1534427-B1 AN ADAMANTYL CATALYST SYSTEM LUCITE INT UK LTD (GB) 2009-10-21 EP disclosed
US-7485739-B2 Catalyst system LUCITE INTERNATIONAL UK LTD. (GB) 2009-02-03 US disclosed
US-7371705-B2 Phospha-adamantane(s) catalytic system LUCITE INTERNATIONAL UK LIMITED (GB) 2008-05-13 US disclosed
US-20060252935-A1 Catalyst system LUCITE INTERNATIONAL UK LIMITED (GB) 2006-11-09 US disclosed
US-20060106259-A1 Phospha-adamantane(s) catalytic system LUCITE INTERNATIONAL UK LIMITED (GB) 2006-05-18 US disclosed
EP-1554039-A2 A CATALYST SYSTEM COMPRISING A 1,2-BIS-(PHOSPHINOALKYL)FERROCENE LIGAND Lucite International UK Limited (GB) 2005-07-20 EP disclosed
EP-1534427-A1 AN ADAMANTYL CATALYTIC SYSTEM Lucite International UK Limited (GB) 2005-06-01 EP disclosed
WO-2004024322-A2 A CATALYST SYSTEM COMPRISING A 1,2-BIS-(PHOSPHINOALKYL) FERROCENE LIGAND LUCITE INTERNATIONAL UK LIMITED (GB) 2004-03-25 WO disclosed
WO-2004014552-A1 A PHOSPHA-ADAMANTANE (S) CATALYTIC SYSTEM LUCITE INTERNATIONAL UK LIMITED (GB) 2004-02-19 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 (3 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-20060106259-A1 Phospha-adamantane(s) catalytic system ADORA2A, ADORA3, ADGRE5 CYP2C9 1206/4885EPHX2 1360/4885EPHX1 1559/4885
US-20060252935-A1 Catalyst system ELOB, SOD1, ESR1 CYP2C9 436/4885EPHX2 255/4885EPHX1 291/4885
US-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP CYP2C9 655/4885EPHX2 2258/4885EPHX1 1477/4885

“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.