SCHEMBL919014

SCHEMBL919014

CCCc1c(O)cc(C=Cc2c(F)cccc2F)cc1O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 2/20 0.46
KCNH2 Q12809 5/20 0.43
MAT2A P31153 2/20 0.43
TTR P02766 1/20 0.40
PTGS1 P23219 2/20 0.37
NQO2 P16083 1/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
TUBB1 Q9H4B7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
KAT6A Q92794 1/20 0.36
PTGS2 P35354 2/20 0.35
ALOX5 P09917 1/20 0.35
CYP19A1 P11511 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.35

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
SCHEMBL6450486 0.86 PPARG (0.41) PTGS1NQO2MAOAMAOBTUBB1
SCHEMBL6311612 0.86 PPARG (0.41) PTGS1NQO2MAOAMAOBTUBB1
SCHEMBL6450483 0.86 PPARG (0.41) PTGS1NQO2MAOAMAOBTUBB1
SCHEMBL6465417 0.84 NFE2L2 (0.51) NFE2L2PTGS1MAOBKDM4EPTGS2
SCHEMBL6465420 0.84 NFE2L2 (0.51) NFE2L2PTGS1MAOBKDM4EPTGS2
SCHEMBL918502 0.84 NFE2L2 (0.51) NFE2L2PTGS1MAOBKDM4EPTGS2
SCHEMBL6469243 0.83 NPC1 (0.37) TTRPTGS1MAOAMAOBTUBB1
SCHEMBL6469241 0.83 NPC1 (0.37) TTRPTGS1MAOAMAOBTUBB1
SCHEMBL918379 0.83 NPC1 (0.37) TTRPTGS1MAOAMAOBTUBB1
SCHEMBL918488 0.82 PTGS1 (0.59) NFE2L2PTGS1NQO2PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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-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
EP-1554236-A1 NOVEL BIOACTIVE DIPHENYL ETHENE COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS Welichem Biotech Inc. (CA) 2005-07-20 EP 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
WO-2004031117-A1 NOVEL BIOACTIVE DIPHENYL ETHENE COMPOUNDS AND THEIR THERAPEUTIC APPLICATIONS WELICHEM BIOTECH INC. (CA) 2004-04-15 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-20050059733-A1 Anti-inflammatory and psoriasis treatment and protein kinase inhibition by hydroxy stilbenes and novel stilbene derivatives and analogues NFKBIA, IKBKB, IKBKE NFE2L2 402/4885KCNH2 3762/4885MAT2A 4373/4885
US-20080139666-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxy Stilbenes and Novel Stilbene Derivatives and Analogues LTK, MMP8, CHUK NFE2L2 1037/4885KCNH2 4755/4885MAT2A 3266/4885
US-20100094041-A1 ANTI-INFLAMMATORY AND PSORIASIS TREATMENT AND PROTEIN KINASE INHIBITION BY HYDROXY STILBENES AND NOVEL STILBENE DERIVATIVES AND ANALOGUES CHUK, MAP3K8, MAP3K1 NFE2L2 1428/4885KCNH2 4179/4885MAT2A 3537/4885

“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.