SCHEMBL4136685

SCHEMBL4136685

COc1ccc(CC2S/C(=N\c3ccc(C)cc3)NC2=O)cc1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.60
MEN1 O00255 4/20 0.55
RAB9A P51151 1/20 0.55
POLB P06746 2/20 0.53
ALDH1A1 P00352 3/20 0.53
LMNA P02545 3/20 0.53
ESR1 P03372 1/20 0.52
GAA P10253 1/20 0.49
ALOX5 P09917 1/20 0.48
GLA P06280 1/20 0.46
MAPT P10636 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTT P42858 1/20 0.45

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
SCHEMBL4136686 1.00 KMT2A (0.60) KMT2AMEN1RAB9APOLBALDH1A1
SCHEMBL4128368 0.89 KMT2A (0.58) KMT2AMEN1RAB9APOLBALDH1A1
SCHEMBL4128369 0.89 KMT2A (0.58) KMT2AMEN1RAB9APOLBALDH1A1
SCHEMBL4140204 0.88 ALDH1A1 (0.54) KMT2AMEN1RAB9APOLBALDH1A1
SCHEMBL4140201 0.88 ALDH1A1 (0.54) KMT2AMEN1RAB9APOLBALDH1A1
SCHEMBL4143380 0.85 KMT2A (0.63) KMT2AMEN1ALDH1A1LMNAESR1
SCHEMBL4150233 0.85 KMT2A (0.62) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL4143382 0.85 KMT2A (0.63) KMT2AMEN1ALDH1A1LMNAESR1
SCHEMBL4150236 0.85 KMT2A (0.62) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL4143006 0.82 PPARG (0.62) KMT2AMEN1ALDH1A1LMNAESR1

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 KMT2A 1742/4885MEN1 645/4885RAB9A 3310/4885
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids FFAR2, FFAR1, FFAR4 KMT2A 1701/4885MEN1 2016/4885RAB9A 3790/4885

“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.