SCHEMBL2893613

SCHEMBL2893613

N#Cc1c(NC(=O)CCC2CCCCC2)sc2c1CCN(C(=O)NCc1ccccn1)C2

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.53
▸ KMT2A Q03164 4/20 0.53
▸ HPGD P15428 2/20 0.53
▸ STAT3 P40763 2/20 0.49
▸ GRM1 Q13255 6/20 0.44
▸ MAPK9 P45984 1/20 0.44
▸ MAPK10 P53779 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ RECQL P46063 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
SCHEMBL2887735 0.93 STAT3 (0.47) MEN1KMT2AHPGDSTAT3GRM1
SCHEMBL3415429 0.90 MEN1 (0.51) MEN1KMT2AHPGDSTAT3GRM1
SCHEMBL3423426 0.89 MAPK10 (0.49) MEN1KMT2AHPGDSTAT3GRM1
SCHEMBL2895632 0.88 MEN1 (0.48) MEN1KMT2ASTAT3GRM1MAPK9
SCHEMBL2887976 0.87 MEN1 (0.49) MEN1KMT2ASTAT3GRM1MAPK9
SCHEMBL2886927 0.86 MEN1 (0.58) MEN1KMT2AHPGDSTAT3GRM1
SCHEMBL2895790 0.84 SMN1; SMN2 (0.51) MEN1KMT2AL3MBTL1
SCHEMBL2893475 0.83 MEN1 (0.47) MEN1KMT2ASTAT3GRM1MAPK9
SCHEMBL2893432 0.82 MEN1 (0.48) MEN1KMT2ASTAT3GRM1MAPK9
SCHEMBL2891842 0.81 STAT3 (0.49) MEN1KMT2ASTAT3L3MBTL1RECQL

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 2606/4885HPGD 2616/4885

“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.

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