SCHEMBL1658730

SCHEMBL1658730

NS(=O)(=O)NCC(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 13/20 0.45
CA1 P00915 11/20 0.45
CA7 P43166 2/20 0.45
CA13 Q8N1Q1 1/20 0.45
CA9 Q16790 6/20 0.39
ARG1 P05089 2/20 0.34
CA12 O43570 5/20 0.33
CA14 Q9ULX7 1/20 0.33
KIF11 P52732 1/20 0.32
CA5A P35218 1/20 0.30

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
SCHEMBL1024523 0.74 CA1 (0.33) CA2CA1CA7CA13
SCHEMBL31607593 0.72 CA1 (0.32) CA2CA1CA7CA13
SCHEMBL3573472 0.72 EPHX1 (0.45) CA2CA1CA7CA13
SCHEMBL3371130 0.72 CA1 (0.32) CA2CA1CA7CA13
SCHEMBL2835677 0.72 POLB (0.34) CA2CA1CA7CA13CA9
SCHEMBL13225635 0.72 CA2 (0.42) CA2CA1CA7CA13CA9
SCHEMBL15465474 0.70 LMNA (0.33) CA2CA1CA7CA13
SCHEMBL15226205 0.70 CETP (0.38) CA2CA1CA7CA13
SCHEMBL9630741 0.70 PNMT (0.30) CA2CA1CA7CA13
Potassium Ion SCHEMBL9633093 0.70 PNMT (0.30) CA2CA1CA7CA13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2488031-A1 DIARYL ETHER DERIVATIVES AS NOTCH SPARING GAMMA SECRETASE INHIBITORS Merck Sharp & Dohme Corp. (US) 2012-08-22 EP claimed
WO-2011046774-A1 DIARYL ETHER DERIVATIVES AS NOTCH SPARING GAMMA SECRETASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-04-21 WO claimed
US-11319305-B2 Pyrimidine sulfamide derivative and preparation method and medical application thereof Shijiazhuang Sagacity New Drug Development Co., Ltd. (CN) 2022-05-03 US disclosed
US-20200283425-A1 PYRIMIDINE SULFAMIDE DERIVATIVE AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF Wuxi Biocity Biopharmaceutics Co., Ltd. (CN) 2020-09-10 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 (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-11319305-B2 Pyrimidine sulfamide derivative and preparation method and medical application thereof TBXA2R, P2RY11, TPMT CA2 3961/4885CA1 4518/4885CA7 4406/4885
US-20200283425-A1 PYRIMIDINE SULFAMIDE DERIVATIVE AND PREPARATION METHOD AND MEDICAL APPLICATION THEREOF TBXA2R, P2RY11, TPMT CA2 3961/4885CA1 4518/4885CA7 4406/4885

“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.