SCHEMBL3273282

SCHEMBL3273282

O=C(C=Cc1ccc(-c2ccccc2)cc1)Nc1cc(Cl)ccc1S(=O)(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 5/20 0.57
LTB4R Q15722 4/20 0.57
TRPM2 O94759 3/20 0.54
TRPA1 O75762 1/20 0.53
MMP1 P03956 4/20 0.52
MMP2 P08253 4/20 0.52
MMP9 P14780 4/20 0.52
MAOA P21397 2/20 0.52
MAOB P27338 2/20 0.52
HDAC2 Q92769 2/20 0.50
TP53 P04637 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
NPC1 O15118 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49

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
SCHEMBL3273278 1.00 EGFR (0.57) EGFRLTB4RTRPM2TRPA1MMP1
SCHEMBL3280709 0.85 EGFR (0.50) EGFRTRPA1MMP1MMP2MMP9
SCHEMBL3280717 0.85 EGFR (0.50) EGFRTRPA1MMP1MMP2MMP9
SCHEMBL420926 0.80 TRPM2 (0.74) EGFRLTB4RTRPM2TRPA1HDAC2
SCHEMBL420925 0.80 TRPM2 (0.74) EGFRLTB4RTRPM2TRPA1HDAC2
SCHEMBL11063104 0.77 MMP1 (0.63) EGFRLTB4RTRPM2TRPA1MMP1
SCHEMBL11063103 0.77 MMP1 (0.63) EGFRLTB4RTRPM2TRPA1MMP1
SCHEMBL2271618 0.76 TRPA1 (0.73) EGFRLTB4RTRPM2TRPA1MMP1
SCHEMBL2271620 0.76 TRPA1 (0.73) EGFRLTB4RTRPM2TRPA1MMP1
SCHEMBL418156 0.76 ALDH1A1 (0.59) EGFRLTB4RTRPM2TRPA1TP53

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
US-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-04-08 US claimed
EP-2121569-A2 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2009-11-25 EP claimed
WO-2008074755-A2 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2008-06-26 WO claimed
US-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2010-04-08 US disclosed
EP-2121569-A2 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2009-11-25 EP disclosed
WO-2008074755-A2 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS NEUROSEARCH A/S (DK) 2008-06-26 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-20100087496-A1 NOVEL CINNAMIC AMIDE DERIVATIVES USEFUL AS ION CHANNEL MODULATORS TRPV1, TRPA1, TRPM8 EGFR 2980/4885LTB4R 2132/4885TRPM2 5/4885

“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.