SCHEMBL4137540

SCHEMBL4137540

Cc1ccc(N=C2NC(=O)C(CNCc3cccc(C(F)(F)F)c3)S2)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.46
ALDH1A1 P00352 5/20 0.46
LMNA P02545 3/20 0.46
KMT2A Q03164 2/20 0.44
MAPT P10636 3/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.38
SCN8A Q9UQD0 1/20 0.38
EGFR P00533 1/20 0.38

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
SCHEMBL4137537 1.00 GAA (0.46) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4136135 0.87 KMT2A (0.57) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4136132 0.87 KMT2A (0.57) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4137544 0.86 HSD11B1 (0.54) GAAALDH1A1LMNAKMT2ASMN1; SMN2
SCHEMBL4136991 0.85 GAA (0.48) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4136993 0.85 GAA (0.48) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4130977 0.85 KMT2A (0.46) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4130980 0.85 KMT2A (0.46) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4141017 0.84 GAA (0.48) GAAALDH1A1LMNAKMT2AMAPT
SCHEMBL4141021 0.84 GAA (0.48) GAAALDH1A1LMNAKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090156644-A1 Use of thiazole derivatives and analogues in the treatment of cancer BETAGENON AB (SE) 2009-06-18 US disclosed
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids BETAGENON AB (SE) 2009-05-28 US disclosed
WO-2008065409-A2 COMBINATION FOR USE IN THE TREATMENT OF CANCER, COMPRISING TAMOXIFEN OR AN AROMATASE INHIBITOR BETAGENON AB (SE) 2008-06-05 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 (2 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-20090156644-A1 Use of thiazole derivatives and analogues in the treatment of cancer TBXA2R, TSHR, FOLR1 GAA 2671/4885ALDH1A1 312/4885LMNA 2911/4885
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids FFAR2, FFAR1, FFAR4 GAA 1211/4885ALDH1A1 707/4885LMNA 1756/4885

“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.