SCHEMBL2894265

SCHEMBL2894265

COc1ccccc1C(C)CC(=O)Nc1sc2c(c1C#N)CCN(C(=O)NCc1cccnc1)C2

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.50
KMT2A Q03164 5/20 0.50
STAT3 P40763 3/20 0.47
GRM1 Q13255 8/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
ALDH1A1 P00352 3/20 0.45
MAPT P10636 3/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
KDM4E B2RXH2 1/20 0.44

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
SCHEMBL2887183 0.95 MEN1 (0.49) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2891624 0.93 MEN1 (0.49) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2893542 0.92 MEN1 (0.50) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2955896 0.90 MEN1 (0.53) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2955894 0.90 MEN1 (0.53) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2894025 0.89 MEN1 (0.55) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL3349979 0.89 MEN1 (0.50) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2968927 0.89 MEN1 (0.50) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL3349972 0.89 MEN1 (0.50) MEN1KMT2ASTAT3GRM1L3MBTL1
SCHEMBL2971999 0.89 MEN1 (0.50) MEN1KMT2ASTAT3GRM1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100285149-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES 4SC AG (DE) 2010-11-11 US claimed
US-20100285149-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES 4SC AG (DE) 2010-11-11 US 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 (1 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-20100285149-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES BAX, CCAR2, BCL2 MEN1 4556/4885KMT2A 2606/4885STAT3 461/4885

“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.