SCHEMBL3699148

SCHEMBL3699148

C=CC(=O)Nc1ccc(Sc2ccnc(Cl)n2)cc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 9/20 0.47
F13A1 P00488 1/20 0.43
LMNA P02545 1/20 0.43
TGM1 P22735 1/20 0.43
TGM3 Q08188 1/20 0.43
BTK Q06187 3/20 0.43
FGFR1 P11362 2/20 0.40
FGFR4 P22455 2/20 0.40
GSTO1 P78417 1/20 0.39
TRPV1 Q8NER1 1/20 0.39
EGFR P00533 1/20 0.39

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
SCHEMBL3697492 0.85 BTK (0.56) TGM2BTKEGFR
SCHEMBL13170055 0.84 PLK4 (0.54) EGFR
SCHEMBL13169893 0.80 PLK4 (0.49) BTKEGFR
SCHEMBL13170050 0.80 PLK4 (0.61) TGM2BTKEGFR
SCHEMBL13170045 0.79 ITK (0.51) BTKFGFR1FGFR4EGFR
SCHEMBL13170072 0.79 TGM2 (0.53) TGM2BTKEGFR
SCHEMBL13169472 0.77 ITK (0.53) TGM2BTKEGFR
SCHEMBL3693031 0.76 TGM2 (0.56) TGM2LMNABTKEGFR
SCHEMBL13169555 0.76 PLK4 (0.46) BTKFGFR4EGFR
SCHEMBL13169463 0.76 TGM2 (0.56) TGM2LMNABTKEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2114900-B1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF YM BIOSCIENCES AUSTRALIA PTY (AU) 2018-10-10 EP disclosed
US-9040549-B2 Thiopyrimidine-based compounds and uses thereof YM BIOSCIENCES AUSTRALIA PTY LTD. (US) 2015-05-26 US disclosed
US-8846704-B2 Thiopyrimidine-based compounds and uses thereof YM Biosciences Austraila Pty Ltd (US) 2014-09-30 US disclosed
US-20140051703-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF CYTOPIA RESEARCH PTY LTD. (AU) 2014-02-20 US disclosed
US-20140045848-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF CYTOPIA RESEARCH PTY LTD. (AU) 2014-02-13 US disclosed
US-20100239631-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF YM BIOSCIENCES AUSTRALIA PTY LTD 2010-09-23 US disclosed
EP-2114900-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF Cytopia Research Pty Ltd (AU) 2009-11-11 EP disclosed
WO-2008092199-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF CYTOPIA RESEARCH PTY LTD (AU) 2008-08-07 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 (3 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-20140045848-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF JAK3, JAK1, JAK2 TGM2 965/4885F13A1 3880/4885LMNA 4873/4885
US-20100239631-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF JAK3, JAK1, JAK2 TGM2 965/4885F13A1 3880/4885LMNA 4873/4885
US-20140051703-A1 THIOPYRIMIDINE-BASED COMPOUNDS AND USES THEREOF JAK3, JAK1, JAK2 TGM2 965/4885F13A1 3880/4885LMNA 4873/4885

“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.