SCHEMBL930954

SCHEMBL930954

CCCc1c(OC)cc(/C=C/c2cc(OC)cc(OC)c2)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 5/20 0.61
CYP1B1 Q16678 5/20 0.61
CYP1A2 P05177 4/20 0.61
ABL1 P00519 3/20 0.59
BCR P11274 3/20 0.59
NQO2 P16083 4/20 0.57
TTR P02766 2/20 0.57
ABCG2 Q9UNQ0 1/20 0.57
MYC P01106 1/20 0.57
ALOX5 P09917 3/20 0.53
AHR P35869 3/20 0.51
ESR1 P03372 4/20 0.50
CYP3A4 P08684 2/20 0.50
CYP2C19 P33261 2/20 0.50
ABCB1 P08183 2/20 0.50
TUBB4A P04350 2/20 0.50
TUBB P07437 2/20 0.50
TUBA3C P0DPH7 2/20 0.50
TUBA1B P68363 2/20 0.50
TUBA4A P68366 2/20 0.50

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
SCHEMBL919069 1.00 CYP1A1 (0.61) CYP1A1CYP1B1CYP1A2ABL1BCR
SCHEMBL6449307 0.87 TUBB1 (0.63) CYP1A1CYP1B1CYP1A2ABL1BCR
SCHEMBL918728 0.87 TUBB1 (0.63) CYP1A1CYP1B1CYP1A2ABL1BCR
SCHEMBL8009626 0.83 CYP1A2 (0.44) CYP1A2CYP3A4ALDH1A1MAPK1
SCHEMBL6453162 0.81 TUBB1 (0.62) CYP1A1CYP1B1CYP1A2ALOX5CYP3A4
SCHEMBL918107 0.81 PTGS1 (0.44) CYP1A1CYP1B1CYP1A2NQO2ALOX5
SCHEMBL917865 0.81 TUBB1 (0.62) CYP1A1CYP1B1CYP1A2ALOX5CYP3A4
SCHEMBL6448424 0.79 TUBB1 (0.41) CYP1A1CYP1B1CYP1A2ABL1BCR
SCHEMBL917832 0.79 TUBB1 (0.41) CYP1A1CYP1B1CYP1A2ABL1BCR
SCHEMBL918373 0.79 NFE2L2 (0.61) NQO2ABCB1TUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20080139666-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxy Stilbenes and Novel Stilbene Derivatives and Analogues LTK, MMP8, CHUK CYP1A1 3243/4885CYP1B1 2183/4885CYP1A2 3272/4885
US-20100094041-A1 ANTI-INFLAMMATORY AND PSORIASIS TREATMENT AND PROTEIN KINASE INHIBITION BY HYDROXY STILBENES AND NOVEL STILBENE DERIVATIVES AND ANALOGUES CHUK, MAP3K8, MAP3K1 CYP1A1 2632/4885CYP1B1 1910/4885CYP1A2 2616/4885

“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.