SCHEMBL6427652

SCHEMBL6427652

C=Cc1ccc(C(O)C(=O)Oc2ccc(C=CC=Cc3ccc(OC(C)OCc4ccccc4)cc3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.38
PPARA Q07869 2/20 0.38
LMNA P02545 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GSK3B P49841 2/20 0.36
BACE1 P56817 2/20 0.36
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 1/20 0.36
ALOX5 P09917 1/20 0.35
CA12 O43570 1/20 0.34
AKR1B10 O60218 1/20 0.34
AKR1B1 P15121 1/20 0.34
CA4 P22748 1/20 0.34
CA6 P23280 1/20 0.34
CA5A P35218 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
CA5B Q9Y2D0 1/20 0.34
CNR2 P34972 1/20 0.34

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
SCHEMBL6536741 0.95 LMNA (0.40) PPARGPPARALMNAL3MBTL1ALOX5
SCHEMBL6427959 0.87 PTGS2 (0.38) PPARGPPARALMNALTB4RLTB4R2
SCHEMBL4967303 0.85 ABCG2 (0.40) PPARGPPARALMNAGSK3BBACE1
SCHEMBL8522339 0.84 LMNA (0.35) LMNALTB4RLTB4R2MAOBCYP1A2
SCHEMBL4968186 0.81 PTGS2 (0.36) LMNAL3MBTL1LTB4RLTB4R2
SCHEMBL2973189 0.80 LCK (0.39) PPARGPPARALMNAL3MBTL1GSK3B
SCHEMBL5145553 0.78 CYP1A2 (0.50) PPARGPPARALMNAL3MBTL1GSK3B
SCHEMBL5707357 0.73 KDM4E (0.35) LMNACYP2C19
SCHEMBL6281163 0.73 BCHE (0.37) LMNALTB4RLTB4R2SLC5A1SLC5A2
SCHEMBL13469001 0.72 ADRB2 (0.35) ALOX5CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6924323-B2 Sulfonium salt compound WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2005-08-02 US disclosed
US-20040033434-A1 Sulfonium salt compound FUJIFILM WAKO PURE CHEMICAL CORPORATION (JP) 2004-02-19 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-20040033434-A1 Sulfonium salt compound SPIN1, RER1, SPIN2B PPARG 2615/4885PPARA 2616/4885LMNA 4486/4885

“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.