SCHEMBL5065477

SCHEMBL5065477

Cc1ncnc2sc(-c3cccc([N+](=O)[O-])c3)nc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.48
MGAM O43451 1/20 0.48
GAA P10253 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
TDP1 Q9NUW8 2/20 0.44
ALDH1A1 P00352 2/20 0.43
PDE4D Q08499 3/20 0.43
MAPT P10636 3/20 0.42
ADORA3 P0DMS8 3/20 0.42
THRB P10828 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CYP1A2 P05177 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MMP2 P08253 1/20 0.40
MMP9 P14780 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
SCHEMBL14031769 0.85 MAPT (0.46) PKMMGAMGAASIMGAM2
SCHEMBL28033436 0.76 PKM (0.54) PKMMGAMGAASIMGAM2
SCHEMBL8866822 0.72 RAB9A (0.72) PKMMGAMGAASIMGAM2
SCHEMBL10339419 0.72 MGAM (0.58) PKMMGAMGAASIMGAM2
SCHEMBL2652277 0.70 MGAM (0.56) PKMMGAMGAASIMGAM2
SCHEMBL14281772 0.69 MGAM (0.46) PKMMGAMGAASIMGAM2
SCHEMBL8396940 0.69 APP (0.72) PKMMGAMGAASIMGAM2
SCHEMBL7535965 0.69 MGAM (0.66) PKMMGAMGAASIMGAM2
SCHEMBL219670 0.68 BCHE (0.55) PKMMGAMGAASIMGAM2
SCHEMBL22744076 0.68 PIK3CD (0.59) ALDH1A1ADORA3RAB9AMEN1KMT2A

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-20080269238-A1 Thiazolopyrimidine Derivative TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-10-30 US disclosed
EP-1731523-A1 THIAZOLOPYRIMIDINE DERIVATIVE Takeda Pharmaceutical Company Limited (JP) 2006-12-13 EP 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-20080269238-A1 Thiazolopyrimidine Derivative FGFR3, FGFR1, ERBB3 PKM 2651/4885MGAM 4540/4885GAA 4409/4885

“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.