SCHEMBL4137563

SCHEMBL4137563

Cc1ccc(/N=C2/NC(=O)C(CCc3ccccc3)S2)cc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.62
GAA P10253 1/20 0.51
ALDH1A1 P00352 5/20 0.50
MAPT P10636 4/20 0.50
LMNA P02545 4/20 0.50
MAPK1 P28482 1/20 0.47
HSD11B1 P28845 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.44
HTT P42858 1/20 0.44
GLA P06280 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43

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
SCHEMBL4137564 1.00 KMT2A (0.62) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4136084 0.93 KMT2A (0.60) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4136086 0.93 KMT2A (0.60) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4140201 0.86 ALDH1A1 (0.54) KMT2AGAAALDH1A1LMNAMEN1
SCHEMBL4130980 0.84 KMT2A (0.46) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4130977 0.84 KMT2A (0.46) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4131921 0.82 KMT2A (0.62) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4131925 0.82 KMT2A (0.62) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4143963 0.78 KMT2A (0.45) KMT2AGAAALDH1A1MAPTLMNA
SCHEMBL4143966 0.78 KMT2A (0.45) KMT2AGAAALDH1A1MAPTLMNA

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 14 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 claimed
WO-2008090327-A1 NEW COMBINATION FOR USE IN THE TREATMENT OF CANCER BETAGENON AB (SE) 2008-07-31 WO claimed
WO-2008065409-A2 COMBINATION FOR USE IN THE TREATMENT OF CANCER, COMPRISING TAMOXIFEN OR AN AROMATASE INHIBITOR BETAGENON AB (SE) 2008-06-05 WO claimed
EP-1906955-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN THE TREATMENT OF CANCER Betagenon AB (SE) 2008-04-09 EP claimed
WO-2007010273-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN THE TREATMENT OF CANCER BETAGENON AB (SE) 2007-01-25 WO claimed
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-2008090327-A1 NEW COMBINATION FOR USE IN THE TREATMENT OF CANCER BETAGENON AB (SE) 2008-07-31 WO disclosed
WO-2008090356-A1 THIAZOLIDINONE DERIVATIVES USEFUL IN THE TREATMENT OF CANCER AND DISORDERS CAUSED BY EXCESS ADIPOSITY BETAGENON AB (SE) 2008-07-31 WO 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
EP-1906956-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN DISORDERS CAUSED BY FREE FATTY ACIDS Betagenon AB (SE) 2008-04-09 EP disclosed
EP-1906955-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN THE TREATMENT OF CANCER Betagenon AB (SE) 2008-04-09 EP disclosed
WO-2007010281-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN DISORDERS CAUSED BY FREE FATTY ACIDS BETAGENON AB (SE) 2007-01-25 WO disclosed
WO-2007010273-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN THE TREATMENT OF CANCER BETAGENON AB (SE) 2007-01-25 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 KMT2A 1742/4885GAA 2671/4885ALDH1A1 312/4885
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids FFAR2, FFAR1, FFAR4 KMT2A 1701/4885GAA 1211/4885ALDH1A1 707/4885

“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.