SCHEMBL4576554

SCHEMBL4576554

COc1cc(C=Cc2ccc(C(=O)O)cc2)cc(OC)c1C(C)C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL12 P48061 2/20 0.52
MKNK2 Q9HBH9 1/20 0.48
XDH P47989 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
GAA P10253 2/20 0.47
MAPT P10636 2/20 0.47
POLB P06746 3/20 0.46
CASP6 P55212 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
ABL1 P00519 1/20 0.46
EGFR P00533 1/20 0.46
ABL2 P42684 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA7 P43166 1/20 0.46
TPMT P51580 1/20 0.46

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
SCHEMBL4576550 1.00 CXCL12 (0.52) CXCL12MKNK2XDHNPC1RAB9A
SCHEMBL4576720 0.85 TTR (0.55) CXCL12NPC1RAB9AMAPTPOLB
SCHEMBL4576719 0.85 TTR (0.55) CXCL12NPC1RAB9AMAPTPOLB
SCHEMBL5693344 0.83 PKM (0.61) CXCL12MKNK2XDHNPC1RAB9A
SCHEMBL5693342 0.83 PKM (0.61) CXCL12MKNK2XDHNPC1RAB9A
SCHEMBL4254456 0.81 ABCG2 (0.67) CXCL12NPC1RAB9AGAAMAPT
SCHEMBL4254451 0.81 ABCG2 (0.67) CXCL12NPC1RAB9AGAAMAPT
SCHEMBL918999 0.81 TUBB1 (0.66) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL919000 0.81 TUBB1 (0.66) MAPTTUBB4ATUBBTUBA3CTUBA1B
SCHEMBL918500 0.80 AHR (0.68) CXCL12MKNK2NPC1RAB9AMAPT

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 6 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 claimed
CN-1688535-A Novel bioactive diphenyl ethene compounds and their therapeutic applications WELICHEM BIOTECH INC (CA) 2005-10-26 CN claimed
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-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-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

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-20080255245-A1 Anti-Inflammatory and Psoriasis Treatment and Protein Kinase Inhibition by Hydroxystilbenes and Novel Stilbene Derivatives and Analogues NFKBIA, IKBKB, IKBKE CXCL12 2212/4885MKNK2 191/4885XDH 2220/4885

“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.