SCHEMBL6033951

SCHEMBL6033951

CCOC(=O)CSc1nc2sc(C(C)C)c(-c3ccccc3F)c2c(=O)n1-c1cccc(F)c1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 15/20 0.77
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
MAPT P10636 2/20 0.49
THRB P10828 1/20 0.49

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
SCHEMBL6034349 0.91 TGM2 (0.77) TGM2MEN1KMT2AMAPTTHRB
SCHEMBL6037618 0.89 TGM2 (0.75) TGM2MEN1KMT2AMAPTTHRB
SCHEMBL6034975 0.87 TGM2 (1.00) TGM2
SCHEMBL6033427 0.83 TGM2 (0.74) TGM2
SCHEMBL6034973 0.81 TGM2 (0.71) TGM2MEN1KMT2A
SCHEMBL6034031 0.80 TGM2 (0.75) TGM2MEN1KMT2AMAPTTHRB
SCHEMBL6033367 0.78 TGM2 (0.74) TGM2MEN1KMT2A
SCHEMBL6034013 0.78 TGM2 (1.00) TGM2
SCHEMBL6037643 0.77 TGM2 (0.74) TGM2MEN1KMT2AMAPTTHRB
SCHEMBL6034116 0.77 TGM2 (0.78) TGM2

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-20060183759-A1 Tissue transglutaminase inhibitors BRIGHAM AND WOMEN'S HOSPITAL, INC., THE 2006-08-17 US disclosed
WO-2006060702-A1 SUBSTITUED 3,4-DIHYDROTHIENO [2,3-D] PYRMIDINES AS TISSUE TRANSGLUTAMINASE INHIBITORS THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2006-06-08 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 (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 1/4885MEN1 2068/4885KMT2A 1045/4885

“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.