SCHEMBL1319983

SCHEMBL1319983

CCCCC(C(=O)O)N(c1ccc2cc(-c3noc(=O)[nH]3)ccc2c1)S(=O)(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 1/20 0.40
CMKLR1 Q99788 4/20 0.40
LTB4R2 Q9NPC1 1/20 0.37
PLA2G2A P14555 10/20 0.36
PLA2G10 O15496 1/20 0.35
PLA2G1B P04054 1/20 0.35
PLA2G5 P39877 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL1110337 0.84 FFAR1 (0.40)
SCHEMBL1321251 0.84 MMP12 (0.36) ALDH1A1
SCHEMBL1110146 0.84 MMP2 (0.36)
SCHEMBL1110312 0.83 CASP3 (0.35)
SCHEMBL1110265 0.83 PSEN1 (0.36) ALDH1A1
SCHEMBL1110250 0.82 MMP12 (0.38) ALDH1A1
SCHEMBL1110145 0.82 KDM4E (0.41) ALDH1A1
SCHEMBL1110323 0.82 MMP12 (0.38) ALDH1A1
SCHEMBL1110198 0.81 CYP3A4 (0.36)
SCHEMBL1110486 0.81 MMP12 (0.35) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-03 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-20110269761-A1 ARYLSULPHONYLGLYCINE DERIVATIVES, THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS SULT2A1, UGT1A1, SLC5A1 PLA2G4A 2212/4885CMKLR1 2321/4885LTB4R2 2234/4885

“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.