SCHEMBL4409933

SCHEMBL4409933

[Li]C1C(C)=Cc2cc3c(cc21)C(C)(C)CCC3(C)C

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RXRA P19793 14/20 0.36
RXRB P28702 12/20 0.36
RARB P10826 9/20 0.36
RARG P13631 9/20 0.36
RXRG P48443 8/20 0.36
RARA P10276 8/20 0.36
CYP26A1 O43174 2/20 0.32
CYP3A4 P08684 1/20 0.32
CRABP2 P29373 1/20 0.32
CYP26B1 Q9NR63 1/20 0.32

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
SCHEMBL31746176 0.73 RARB (0.31) RXRARXRBRARBRARGRXRG
SCHEMBL4564959 0.73 RARB (0.31) RXRARXRBRARBRARGRXRG
SCHEMBL31294415 0.72 RARA (0.36) RXRARXRBRARBRARGRXRG
SCHEMBL4970465 0.70
Hydrochloric Acid SCHEMBL2237817 0.70 RXRA (0.33) RXRARXRBRARBRARGRXRG
SCHEMBL29853980 0.68 NPC1 (0.31)
SCHEMBL4324596 0.67
SCHEMBL2355383 0.66
SCHEMBL21244356 0.66 RXRA (0.33) RXRARXRBRARBRARGRXRG
SCHEMBL6908994 0.65 RXRA (0.35) RXRARXRBRARBRARGRXRG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7601666-B2 Provide polymers having high molecular weight as well as good crystallinity preferably prepared at higher temperatures and productivities than otherwise possible EXXONMOBIL CHEMICAL PATENTS INC. (US) 2009-10-13 US disclosed
EP-1765841-B1 OLEFIN POLYMERIZATION CATALYST SYSTEM AND PROCESS FOR USE THEREOF EXXONMOBIL CHEM PATENTS INC (US) 2008-10-08 EP disclosed
CN-101124235-A Olefin polymerization catalyst system and method of using same EXXONMOBIL CHEM PATENTS INC (US) 2008-02-13 CN disclosed
US-20060009595-A1 Olefin polymerization catalyst system and process for use thereof EXXONMOBIL CHEMICAL PATENTS INC. 2006-01-12 US 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 (1 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-20060009595-A1 Olefin polymerization catalyst system and process for use thereof OR10J3, CHRM2, CHRM1 RXRA 1309/4885RXRB 1474/4885RARB 3171/4885

“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.