SCHEMBL5085210

SCHEMBL5085210

CCC=Cc1ccccc1OC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 5/20 0.58
TRPA1 O75762 1/20 0.58
TFEB P19484 1/20 0.55
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 2/20 0.54
TSHR P16473 1/20 0.54
CYP1A1 P04798 3/20 0.53
CYP1A2 P05177 3/20 0.53
CYP1B1 Q16678 3/20 0.53
CYP19A1 P11511 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
NPC1 O15118 2/20 0.49
MAPT P10636 2/20 0.49
RAB9A P51151 2/20 0.49
LMNA P02545 1/20 0.49
BCHE P06276 1/20 0.49
GRIK1 P39086 1/20 0.48
GRIK2 Q13002 1/20 0.48
GRIK3 Q13003 1/20 0.48
ALOX5 P09917 1/20 0.47

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
SCHEMBL29372144 1.00 NFE2L2 (0.58) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL257125 1.00 NFE2L2 (0.58) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL30678623 0.88 NFE2L2 (0.62) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL29805387 0.88 NFE2L2 (0.62) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL10781099 0.86 NFE2L2 (0.41) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL11432051 0.85 NFE2L2 (0.55) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL11432044 0.85 NFE2L2 (0.55) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL13570118 0.83 NFE2L2 (0.60) NFE2L2KDM4ECYP1A1CYP1A2CYP1B1
SCHEMBL1603719 0.83 NFE2L2 (0.79) NFE2L2TRPA1TFEBKDM4EALDH1A1
SCHEMBL4019329 0.83 NFE2L2 (0.79) NFE2L2TRPA1TFEBKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286195-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING AbbVie Inc. (US) 2018-02-28 EP disclosed
WO-2016168638-A1 INDAZOLONES AS MODULATORS OF TNF SIGNALING ABBVIE INC. (US) 2016-10-20 WO disclosed
EP-1658298-B1 PHOSPHORUS-CONTAINING IMIDAZOLINES AND METAL COMPLEXES THEREOF SOLVIAS AG (CH) 2008-03-26 EP disclosed
US-20070010493-A1 Phospinite-imidazolines and metal complexes thereof SOLVIAS AG (CH) 2007-01-11 US disclosed
EP-1658298-A2 NOVEL ORGANIC COMPOUNDS AND METAL COMPLEXES Solvias AG (CH) 2006-05-24 EP disclosed
WO-2005021562-A2 PHOSPINITE-IMIDAZOLINES AND METAL COMPLEXES THEREOF SOLVIAS AG (CH) 2005-03-10 WO disclosed
EP-1478403-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA, INC. (CA) 2004-11-24 EP disclosed
WO-2003063909-A1 RESPONSIVE MICROGEL AND METHODS RELATED THERETO SUPRATEK PHARMA INC. (US) 2003-08-07 WO disclosed
US-4962253-A Vinylation of aromatics catalyzed by cyclopentadienyl, indenyl, or fluorenyl rhodium complexes, and novel indenyl and fluorenyl rhodium complexes THE DOW CHEMICAL COMPANY (US) 1990-10-09 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-20070010493-A1 Phospinite-imidazolines and metal complexes thereof H1-0, H1-2, H1-3 NFE2L2 650/4885TRPA1 508/4885TFEB 4819/4885

“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.