SCHEMBL1925953

SCHEMBL1925953

Cc1cn(Cc2ccc(F)c(F)c2)c2c(C#N)cc(F)cc12

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PTGER3 P43115 15/20 0.49
▸ CACNA1H O95180 3/20 0.38
▸ CACNA1G O43497 1/20 0.37
▸ CACNA1I Q9P0X4 1/20 0.37
▸ CHKA P35790 1/20 0.36

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
SCHEMBL1926719 0.82 PTGER3 (0.56) PTGER3
SCHEMBL1924422 0.81 PTGER3 (0.52) PTGER3
SCHEMBL1926683 0.79 PTGER3 (0.49) PTGER3
SCHEMBL1926685 0.79 PTGER3 (0.49) PTGER3
SCHEMBL1926098 0.77 PTGER3 (0.56) PTGER3
SCHEMBL1925005 0.75 PTGER3 (0.52) PTGER3
SCHEMBL5514366 0.74 PTGER3 (0.44) PTGER3CACNA1HCACNA1GCACNA1I
SCHEMBL1925289 0.74 PTGER3 (0.53) PTGER3
SCHEMBL1924074 0.70 PTGER3 (0.58) PTGER3
SCHEMBL4317788 0.69 PTGER3 (0.66) PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812426-B1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE DECODE GENETICS EHF (IS) 2011-06-08 — — EP disclosed
US-20090075985-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE DECODE GENETICS INC. (US) 2009-03-19 — — US disclosed
EP-1812426-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE Decode Genetics, Inc. (US) 2007-08-01 — — EP disclosed
US-20060142348-A1 Aryl sulfonamide peri-substituted bicyclics for occlusive artery disease DECODE CHEMISTRY, INC. (US) 2006-06-29 — — US disclosed
WO-2006044405-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE DECODE GENETICS, INC. (US) 2006-04-27 — — 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 (2 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-20060142348-A1 Aryl sulfonamide peri-substituted bicyclics for occlusive artery disease PTGIS, PTGIR, TBXA2R PTGER3 19/4885CACNA1H 2846/4885CACNA1G 2764/4885
US-20090075985-A1 ARYL SULFONAMIDE PERI-SUBSTITUTED BICYCLICS FOR OCCLUSIVE ARTERY DISEASE PTGIS, PTGIR, TBXA2R PTGER3 19/4885CACNA1H 2846/4885CACNA1G 2764/4885

“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.

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