SCHEMBL10064237

SCHEMBL10064237

CN1C(=O)C(=O)c2cc(S(=O)(=O)N3CCN(C(=O)COc4ccccc4)CC3)ccc21

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PKM P14618 5/20 0.63
▸ ALDH1A1 P00352 3/20 0.63
▸ CASP3 P42574 2/20 0.59
▸ CASP7 P55210 2/20 0.59
▸ GAA P10253 2/20 0.56
▸ SMN1; SMN2 Q16637 1/20 0.56
▸ LMNA P02545 1/20 0.53
▸ MEN1 O00255 1/20 0.51
▸ KMT2A Q03164 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
SCHEMBL9951626 0.80 PKM (0.73) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL9950690 0.79 PKM (0.83) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL10064236 0.79 PKM (0.59) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL12943745 0.79 PKM (0.71) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL752279 0.79 GAA (0.85) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL9951161 0.78 PKM (0.71) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL9950741 0.77 PKM (0.78) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL945098 0.76 PKM (0.67) PKMALDH1A1GAASMN1; SMN2LMNA
SCHEMBL28086690 0.76 CASP7 (0.53) CASP3CASP7SMN1; SMN2
SCHEMBL10064245 0.76 PKM (0.66) PKMALDH1A1GAASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2448581-B1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS OF USE AGIOS PHARMACEUTICALS INC (US) 2016-12-07 — — EP disclosed
US-9115086-B2 Therapeutic compositions and related methods of use AGIOS PHARMACEUTICALS, INC. (US) 2015-08-25 — — US disclosed
US-9115086-B2 Therapeutic compositions and related methods of use AGIOS PHARMACEUTICALS, INC. (US) 2015-08-25 — — US disclosed
US-20120165324-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS OF USE AGIOS PHARMACEUTICALS, INC. 2012-06-28 — — US disclosed
US-20120165324-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS OF USE AGIOS PHARMACEUTICALS, INC. 2012-06-28 — — 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-20120165324-A1 THERAPEUTIC COMPOSITIONS AND RELATED METHODS OF USE PDK2, PDK1, PDK3 PKM 10/4885ALDH1A1 1240/4885CASP3 1974/4885

“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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