SCHEMBL1808245

SCHEMBL1808245

COC(=O)c1cccc(C(=O)N2CCC(Oc3ccc(Cl)cc3)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RHOA P61586 1/20 0.57
MGLL Q99685 8/20 0.56
HRH1 P35367 2/20 0.55
CCR3 P51677 2/20 0.55
RBP4 P02753 1/20 0.53
EPHX2 P34913 3/20 0.50
HRH3 Q9Y5N1 1/20 0.50
PRSS12 P56730 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
SCHEMBL1805362 0.88 HRH1 (0.57) MGLLHRH1CCR3HRH3PRSS12
SCHEMBL1808919 0.88 MGLL (0.59) MGLLHRH3
SCHEMBL1808355 0.88 L3MBTL3 (0.58) MGLLHRH1CCR3EPHX2HRH3
SCHEMBL1809338 0.87 MGLL (0.73) MGLLHRH1CCR3
SCHEMBL1808762 0.87 HRH1 (0.70) MGLLHRH1CCR3EPHX2HRH3
SCHEMBL1806803 0.87 HRH3 (0.51) MGLLEPHX2HRH3PRSS12
SCHEMBL1806214 0.86 HRH1 (0.57) MGLLHRH1CCR3HRH3
SCHEMBL1805983 0.86 MGLL (0.67) RHOAMGLLHRH1CCR3HRH3
SCHEMBL12188732 0.85 MGLL (0.69) MGLLHRH1CCR3HRH3PRSS12
SCHEMBL1806882 0.85 MGLL (0.67) MGLLHRH1CCR3HRH3PRSS12

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-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-09-13 US disclosed
WO-2011058766-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2011-05-19 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-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN1B, SCN1A, SCN2B RHOA 2595/4885MGLL 4513/4885HRH1 819/4885

“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.