SCHEMBL1809727

SCHEMBL1809727

CS(=O)(=O)c1cccc(-c2ccc(C(=O)N3CCC(Oc4ccc(Cl)cc4)CC3)cc2)c1

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 4/20 0.59
CCR3 P51677 3/20 0.59
HRH3 Q9Y5N1 3/20 0.52
EPHX2 P34913 2/20 0.51
MGLL Q99685 6/20 0.49
EIF4A3 P38919 1/20 0.47
PRSS12 P56730 1/20 0.47
KMT2A Q03164 1/20 0.45

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
SCHEMBL1809105 0.89 HRH1 (0.72) HRH1CCR3HRH3EPHX2MGLL
SCHEMBL1807688 0.86 HRH3 (0.63) HRH1CCR3HRH3EPHX2MGLL
SCHEMBL1807050 0.86 HRH3 (0.52) HRH1CCR3HRH3EPHX2MGLL
SCHEMBL1810363 0.83 MGLL (0.52) HRH1CCR3HRH3MGLLPRSS12
SCHEMBL1807640 0.82 HRH3 (0.49) HRH1CCR3HRH3MGLLPRSS12
SCHEMBL1811105 0.82 SCN9A (0.55) HRH3EPHX2MGLLPRSS12
SCHEMBL1811909 0.82 MGLL (0.51) HRH3MGLLPRSS12KMT2A
SCHEMBL22174159 0.82 HRH1 (0.48) HRH1CCR3HRH3EPHX2
SCHEMBL1808366 0.81 HRH3 (0.52) HRH1CCR3HRH3EPHX2MGLL
SCHEMBL1807401 0.81 MEN1 (0.62) HRH1CCR3HRH3EPHX2MGLL

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 10 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 claimed
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-09-13 US claimed
WO-2011058766-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2011-05-19 WO claimed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
US-9051296-B2 Aryl carboxamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2015-06-09 US disclosed
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
US-20120232052-A1 ARYL CARBOXAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-09-13 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 HRH1 819/4885CCR3 2942/4885HRH3 1010/4885

“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.