SCHEMBL16502974

SCHEMBL16502974

COc1cc(S(=O)(=O)Nc2c(C)nn(C)c2C)ccc1NC(C)=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.57
▸ ALDH1A1 P00352 2/20 0.55
▸ NMT1 P30419 3/20 0.51
▸ KMT2A Q03164 3/20 0.50
▸ MEN1 O00255 2/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ LMNA P02545 3/20 0.49
▸ HTT P42858 1/20 0.49
▸ NPSR1 Q6W5P4 1/20 0.47
▸ PKM P14618 1/20 0.46

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
SCHEMBL16502982 0.91 KMT2A (0.58) L3MBTL1ALDH1A1NMT1KMT2AMEN1
SCHEMBL16509495 0.83 FFAR4 (0.60) L3MBTL1NMT1KMT2AMEN1SMN1; SMN2
SCHEMBL16502943 0.79 KMT2A (0.59) L3MBTL1ALDH1A1NMT1KMT2AMEN1
SCHEMBL16509619 0.78 L3MBTL1 (0.71) L3MBTL1ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL18903922 0.78 TP53 (0.44) L3MBTL1ALDH1A1NMT1KMT2AMEN1
SCHEMBL16502967 0.78 NMT1 (0.51) L3MBTL1ALDH1A1NMT1KMT2AMEN1
SCHEMBL13457978 0.74 LMNA (0.66) L3MBTL1ALDH1A1NMT1SMN1; SMN2LMNA
SCHEMBL16502942 0.73 L3MBTL1 (1.00) L3MBTL1NMT1SMN1; SMN2LMNAHTT
SCHEMBL20656507 0.73 ALDH1A1 (0.56) L3MBTL1ALDH1A1KMT2AMEN1SMN1; SMN2
SCHEMBL29553355 0.73 ALDH1A1 (0.56) L3MBTL1ALDH1A1KMT2AMEN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9828346-B2 N-myristoyl transferase inhibitors UNIVERSITY OF DUNDEE (GB) 2017-11-28 — — US disclosed
US-9828346-B2 N-myristoyl transferase inhibitors UNIVERSITY OF DUNDEE (GB) 2017-11-28 — — US disclosed
EP-2980076-B1 Pyrazolyl derivatives UNIV DUNDEE (GB) 2017-05-31 — — EP disclosed
US-20160060224-A1 N-MYRISTOYL TRANSFERASE INHIBITORS UNIVERSITY OF DUNDEE (GB) 2016-03-03 — — US disclosed
US-20160060224-A1 N-MYRISTOYL TRANSFERASE INHIBITORS UNIVERSITY OF DUNDEE (GB) 2016-03-03 — — US disclosed
EP-2980076-A1 PYRAZOLYL DERIVATIVES University of Dundee (GB) 2016-02-03 — — EP disclosed
US-9156811-B2 N-myristoyl transferase inhibitors Univeristy of Dundee (GB) 2015-10-13 — — US disclosed
US-9156811-B2 N-myristoyl transferase inhibitors Univeristy of Dundee (GB) 2015-10-13 — — US disclosed
EP-2323987-B1 N-MYRISTOYL TRANSFERASE INHIBITORS UNIV DUNDEE (GB) 2015-06-24 — — EP disclosed
US-20110312921-A1 N-Myristoyl Transferase Inhibitors DUNDEE, UNIVERSITY OF (GB) 2011-12-22 — — US disclosed
US-20110312921-A1 N-Myristoyl Transferase Inhibitors DUNDEE, UNIVERSITY OF (GB) 2011-12-22 — — 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 (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-20110312921-A1 N-Myristoyl Transferase Inhibitors GNMT, NNMT, SPTLC1 L3MBTL1 1568/4885ALDH1A1 4530/4885NMT1 13/4885
US-20160060224-A1 N-MYRISTOYL TRANSFERASE INHIBITORS GNMT, NNMT, SPTLC1 L3MBTL1 1568/4885ALDH1A1 4530/4885NMT1 13/4885

“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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