SCHEMBL6037626

SCHEMBL6037626

COc1cccc(-c2csc3nc(S)n(-c4cccc(F)c4)c(=O)c23)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 10/20 0.65
PKM P14618 1/20 0.48
MAPK1 P28482 2/20 0.43
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
GRM1 Q13255 1/20 0.42
TP53 P04637 1/20 0.42
TSHR P16473 1/20 0.41
MIF P14174 2/20 0.41
GAA P10253 1/20 0.40

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
SCHEMBL6037628 0.91 TGM2 (0.64) TGM2MAPK1KDM4EALDH1A1LMNA
SCHEMBL6034920 0.90 TGM2 (0.60) TGM2ALDH1A1HSD17B10MAPTGRM1
SCHEMBL6033961 0.89 TGM2 (0.62) TGM2PKMMAPK1KDM4EALDH1A1
SCHEMBL6033953 0.87 TGM2 (0.62) TGM2MAPK1ALDH1A1HSD17B10MAPT
SCHEMBL6034313 0.83 TGM2 (0.64) TGM2ALDH1A1HTTLMNAMAPT
SCHEMBL6037629 0.80 TGM2 (0.61) TGM2KDM4EALDH1A1MAPTGRM1
SCHEMBL6037665 0.79 TGM2 (1.00) TGM2
SCHEMBL6034271 0.79 TGM2 (0.78) TGM2
SCHEMBL6034346 0.79 MAPK1 (0.63) TGM2MAPK1KDM4EALDH1A1HTT
SCHEMBL6034265 0.78 ALDH1A1 (0.52) TGM2MAPK1KDM4EALDH1A1HTT

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-20060183759-A1 Tissue transglutaminase inhibitors BRIGHAM AND WOMEN'S HOSPITAL, INC., THE 2006-08-17 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-20060183759-A1 Tissue transglutaminase inhibitors TGM2, HNMT, TPMT TGM2 1/4885PKM 2016/4885MAPK1 4539/4885

“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.