SCHEMBL13390366

SCHEMBL13390366

Cc1cc(Br)cc(S(=O)(=O)N(CC(=O)OC(C)(C)C)c2ccc3c(ccn3-c3cnc(NCCN(C)C)cn3)c2)c1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPT P10636 1/20 0.30
TSHR P16473 1/20 0.30
TP53 P04637 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
SCHEMBL13390120 0.96 PKM (0.32) PKMHSD17B10MAPTTP53
SCHEMBL13390576 0.95 PKM (0.36) PKMHSD17B10MAPTTSHRTP53
SCHEMBL13390132 0.93 IRAK4 (0.31) PKMHSD17B10TP53
SCHEMBL13390374 0.92 PKM (0.34) PKMHSD17B10MAPTTSHRTP53
SCHEMBL4432483 0.91 KEAP1 (0.34) PKMHSD17B10MAPTTSHR
SCHEMBL13390582 0.90 PKM (0.34) PKMHSD17B10MAPTTSHR
SCHEMBL13390343 0.89 IRAK4 (0.33) PKMHSD17B10MAPTTP53
SCHEMBL4432259 0.86 MAPT (0.34) MAPT
SCHEMBL13391044 0.86 KEAP1 (0.37) PKMHSD17B10MAPTTSHR
SCHEMBL13390309 0.85 PKM (0.33) PKMHSD17B10TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 PKM 117/4885HSD17B10 2472/4885MAPT 947/4885

“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.