SCHEMBL4145482

SCHEMBL4145482

O=C1N/C(=N\c2ccccc2)SC1Cc1cccc(C(F)(F)F)c1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.71
MAPT P10636 5/20 0.55
MAPK1 P28482 1/20 0.55
SMN1; SMN2 Q16637 2/20 0.50
LMNA P02545 3/20 0.47
HTT P42858 2/20 0.47
MEN1 O00255 2/20 0.47
PPARG P37231 2/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.45
CA2 P00918 1/20 0.43
MAOB P27338 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
SCHEMBL4145485 1.00 KMT2A (0.71) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4136140 0.91 KMT2A (0.58) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4136143 0.91 KMT2A (0.58) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4128887 0.90 LMNA (0.59) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4136135 0.90 KMT2A (0.57) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4143345 0.90 SMN1; SMN2 (0.58) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4143343 0.90 SMN1; SMN2 (0.58) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4143891 0.90 KMT2A (0.57) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4143894 0.90 KMT2A (0.57) KMT2AMAPTMAPK1SMN1; SMN2LMNA
SCHEMBL4136132 0.90 KMT2A (0.57) KMT2AMAPTMAPK1SMN1; SMN2LMNA

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 10 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
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids BETAGENON AB (SE) 2009-05-28 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-1906956-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN DISORDERS CAUSED BY FREE FATTY ACIDS Betagenon AB (SE) 2008-04-09 EP claimed
WO-2007010281-A2 USE OF THIAZOLE DERIVATIVES AND ANALOGUES IN DISORDERS CAUSED BY FREE FATTY ACIDS 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-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 KMT2A 1742/4885MAPT 3828/4885MAPK1 3633/4885
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids FFAR2, FFAR1, FFAR4 KMT2A 1701/4885MAPT 2648/4885MAPK1 2809/4885

“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.