SCHEMBL4141086

SCHEMBL4141086

CCOc1ccc(/N=C2/NC(=O)C(CC(=O)Nc3ccccc3)S2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.83
KMT2A Q03164 3/20 0.83
POLB P06746 1/20 0.83
LMNA P02545 2/20 0.76
GAA P10253 2/20 0.64
ALDH1A1 P00352 5/20 0.59
MAPT P10636 4/20 0.55
ADAM17 P78536 1/20 0.55
TSHR P16473 1/20 0.55
MAPK1 P28482 1/20 0.55
MAP2K1 Q02750 1/20 0.53
KDM4E B2RXH2 1/20 0.53
TDP1 Q9NUW8 1/20 0.52
ACHE P22303 1/20 0.51

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
SCHEMBL4141088 1.00 MEN1 (0.83) MEN1KMT2APOLBLMNAGAA
SCHEMBL4153284 0.91 MEN1 (0.85) MEN1KMT2APOLBLMNAGAA
SCHEMBL4153279 0.91 MEN1 (0.85) MEN1KMT2APOLBLMNAGAA
SCHEMBL4133225 0.88 MEN1 (0.79) MEN1KMT2APOLBLMNAGAA
SCHEMBL4133231 0.88 MEN1 (0.79) MEN1KMT2APOLBLMNAGAA
SCHEMBL4451234 0.86 GAA (0.80) MEN1KMT2APOLBLMNAGAA
SCHEMBL4451229 0.86 GAA (0.80) MEN1KMT2APOLBLMNAGAA
SCHEMBL4142556 0.85 POLB (0.90) MEN1KMT2APOLBLMNAGAA
SCHEMBL4142561 0.85 POLB (0.90) MEN1KMT2APOLBLMNAGAA
SCHEMBL4140071 0.82 GAA (0.91) MEN1KMT2APOLBLMNAGAA

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 MEN1 645/4885KMT2A 1742/4885POLB 3365/4885
US-20090136472-A1 Use of thiazole derivatives and analogues in disorders caused by free fatty acids FFAR2, FFAR1, FFAR4 MEN1 2016/4885KMT2A 1701/4885POLB 4011/4885

“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.