SCHEMBL2895632

SCHEMBL2895632

N#Cc1c(NC(=O)CCC2CCCCC2)sc2c1CCN(C(=O)NCc1ccncc1)C2

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ GRM1 Q13255 7/20 0.46
▸ MAPK9 P45984 1/20 0.43
▸ MAPK10 P53779 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ STAT3 P40763 1/20 0.42

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
SCHEMBL2893475 0.92 MEN1 (0.47) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL2887976 0.91 MEN1 (0.49) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL3418594 0.89 MEN1 (0.53) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL3420744 0.88 MEN1 (0.49) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL2893613 0.88 MEN1 (0.53) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL2895790 0.85 SMN1; SMN2 (0.51) MEN1KMT2AL3MBTL1KDM4EALDH1A1
SCHEMBL2893432 0.85 MEN1 (0.48) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL2895337 0.85 MEN1 (0.59) MEN1KMT2AGRM1L3MBTL1KDM4E
SCHEMBL2887735 0.83 STAT3 (0.47) MEN1KMT2AGRM1MAPK9MAPK10
SCHEMBL4056323 0.82 MEN1 (0.53) MEN1KMT2AL3MBTL1KDM4EALDH1A1

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 2606/4885GRM1 2923/4885

“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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