SCHEMBL919617

SCHEMBL919617

CC(C)c1c(O)cc(C=Cc2cccc(F)c2)cc1O

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AHR P35869 1/20 0.68
PTGS1 P23219 5/20 0.63
NQO2 P16083 1/20 0.63
PTGS2 P35354 1/20 0.60
NFE2L2 Q16236 11/20 0.58
APP P05067 3/20 0.48
RELA Q04206 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
SCHEMBL919616 1.00 AHR (0.68) AHRPTGS1NQO2PTGS2NFE2L2
SCHEMBL919556 0.84 AHR (0.62) AHRPTGS1NQO2PTGS2
SCHEMBL919558 0.84 AHR (0.62) AHRPTGS1NQO2PTGS2
SCHEMBL919278 0.81 AHR (0.69) AHRPTGS1NQO2PTGS2NFE2L2
SCHEMBL919277 0.81 AHR (0.69) AHRPTGS1NQO2PTGS2NFE2L2
Tapinarof SCHEMBL918344 0.81 AHR (1.00) AHRPTGS1PTGS2RELA
Tapinarof SCHEMBL918343 0.81 AHR (1.00) AHRPTGS1PTGS2RELA
Tapinarof SCHEMBL28021456 0.81 AHR (1.00) AHRPTGS1PTGS2RELA
SCHEMBL918975 0.81 AHR (0.63) AHRPTGS1NQO2PTGS2NFE2L2
SCHEMBL918974 0.81 AHR (0.63) AHRPTGS1NQO2PTGS2NFE2L2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1688535-B Novel bioactive diphenyl ethene compounds and their therapeutic applications BEIJING WENFENG TIANJI MEDICINE TECHNOLOGY CO LTD 2011-11-09 CN disclosed
US-7868047-B2 Anti-inflammatory and psoriasis treatment and protein kinase inhibition by hydroxy stilbenes and novel stilbene derivatives and analogues WELICHEM BIOTECH INC. (CA) 2011-01-11 US disclosed
US-20100094041-A1 ANTI-INFLAMMATORY AND PSORIASIS TREATMENT AND PROTEIN KINASE INHIBITION BY HYDROXY STILBENES AND NOVEL STILBENE DERIVATIVES AND ANALOGUES WELICHEM BIOTECH INC. (CA) 2010-04-15 US disclosed
US-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues WELICHEM BIOTECH INC. (CA) 2008-10-16 US disclosed
US-20080139666-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxy Stilbenes and Novel Stilbene Derivatives and Analogues WELICHEM BIOTECH INC. (CA) 2008-06-12 US disclosed
US-7321050-B2 Anti-inflammatory and psoriasis treatment and protein kinase inhibition by hydroxy stilbenes and novel stilbene derivatives and analogues WELICHEM BIOTECH INC. (CA) 2008-01-22 US disclosed
CN-1688535-A Novel bioactive diphenyl ethene compounds and their therapeutic applications WELICHEM BIOTECH INC (CA) 2005-10-26 CN disclosed
US-20050059733-A1 Anti-inflammatory and psoriasis treatment and protein kinase inhibition by hydroxy stilbenes and novel stilbene derivatives and analogues WELICHEM BIOTECH, INC. 2005-03-17 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 (4 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-20050059733-A1 Anti-inflammatory and psoriasis treatment and protein kinase inhibition by hydroxy stilbenes and novel stilbene derivatives and analogues NFKBIA, IKBKB, IKBKE AHR 1108/4885PTGS1 275/4885NQO2 2538/4885
US-20080139666-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxy Stilbenes and Novel Stilbene Derivatives and Analogues LTK, MMP8, CHUK AHR 1542/4885PTGS1 430/4885NQO2 3623/4885
US-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues NFKBIA, IKBKB, IKBKE AHR 1017/4885PTGS1 224/4885NQO2 2595/4885
US-20100094041-A1 ANTI-INFLAMMATORY AND PSORIASIS TREATMENT AND PROTEIN KINASE INHIBITION BY HYDROXY STILBENES AND NOVEL STILBENE DERIVATIVES AND ANALOGUES CHUK, MAP3K8, MAP3K1 AHR 1326/4885PTGS1 256/4885NQO2 4022/4885

“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.