SCHEMBL3850148

SCHEMBL3850148

[CH2]c1cc(OC)c(O)cc1I

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CGAS Q8N884 1/20 0.42
MAOB P27338 1/20 0.42
TRPA1 O75762 1/20 0.40
CYP3A4 P08684 4/20 0.38
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.38
HPGD P15428 2/20 0.38
TP53 P04637 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPK1 P28482 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
SNCA P37840 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.37
SLC22A8 Q8TCC7 1/20 0.37
RAB9A P51151 1/20 0.37
ALOX5 P09917 3/20 0.37
AR P10275 1/20 0.37

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
SCHEMBL24110786 0.80 MAOB (0.46) CGASMAOBTRPA1CYP3A4ALDH1A1
SCHEMBL3529271 0.80 MAOB (0.46) MAOBTRPA1CYP3A4ALDH1A1MEN1
SCHEMBL5744783 0.77 MAOB (0.43) CGASMAOBTRPA1CYP3A4ALDH1A1
SCHEMBL2636861 0.76 MAOB (0.46) MAOBTRPA1CYP3A4ALDH1A1MEN1
SCHEMBL5852202 0.75 ALOX5 (0.44) CGASMAOBTRPA1CYP3A4ALDH1A1
SCHEMBL2911478 0.75 MAOB (0.42) CGASMAOBTRPA1CYP3A4ALDH1A1
SCHEMBL69624 0.74 MAOB (0.59) MAOBTRPA1CYP3A4ALDH1A1MEN1
SCHEMBL4662662 0.71 CYP3A4 (0.44) MAOBCYP3A4ALDH1A1TSHRHPGD
SCHEMBL3921025 0.71 CYP3A4 (0.44) MAOBCYP3A4ALDH1A1TSHRHPGD
SCHEMBL3272704 0.71 ALOX5 (0.44) CGASMAOBTRPA1CYP3A4ALDH1A1

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
EP-1805138-B1 SULFONAMIDO COMPOUNDS THAT ANTAGONISE THE VANILLOID TRPV1 RECEPTOR PHARMESTE SRL (IT) 2008-03-19 EP claimed
US-7579378-B2 Sulfonamido compounds that antagonize the vanilloid TRPV1 receptor PHARMESTE S.R.L. (IT) 2009-08-25 US disclosed
US-20090118374-A1 SULFONAMIDO COMPOUNDS THAT ANTAGONISE THE VANILLOID TRPV1 RECEPTOR PHARMESTE S.R.L. (IT) 2009-05-07 US disclosed
EP-1805138-B1 SULFONAMIDO COMPOUNDS THAT ANTAGONISE THE VANILLOID TRPV1 RECEPTOR PHARMESTE SRL (IT) 2008-03-19 EP disclosed
EP-1805138-A1 SULFONAMIDO COMPOUNDS THAT ANTAGONISE THE VANILLOID TRPV1 RECEPTOR Pharmeste S.r.l. (IT) 2007-07-11 EP disclosed
WO-2006045498-A1 SULFONAMIDO COMPOUNDS THAT ANTAGONISE THE VANILLOID TRPV1 RECEPTOR PHARMESTE S.R.L. (IT) 2006-05-04 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 (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-20090118374-A1 SULFONAMIDO COMPOUNDS THAT ANTAGONISE THE VANILLOID TRPV1 RECEPTOR TRPV1, TRPA1, TRPV4 CGAS 2506/4885MAOB 2647/4885TRPA1 2/4885

“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.