SCHEMBL1133853

SCHEMBL1133853

CSCCC(N)C(=O)Oc1ccc(NC(C)=O)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.53
MEN1 O00255 4/20 0.53
HSD17B10 Q99714 4/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LMNA P02545 1/20 0.46
CYP1A2 P05177 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
OPRK1 P41145 1/20 0.45
GAA P10253 1/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
MAPT P10636 2/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
PRSS1 P07477 1/20 0.43
ACR P10323 1/20 0.43

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
SCHEMBL1133955 1.00 KMT2A (0.53) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
SCHEMBL13637985 0.85 KMT2A (0.54) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
Sumacetamol SCHEMBL5185790 0.83 GAA (0.55) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
Sumacetamol SCHEMBL1134071 0.83 GAA (0.55) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
SCHEMBL13637924 0.83 KMT2A (0.51) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
SCHEMBL1133856 0.82 KMT2A (0.57) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
SCHEMBL12229268 0.82 LMNA (0.43) KMT2AMEN1LMNACYP1A2GAA
SCHEMBL12229225 0.82 LMNA (0.43) KMT2AMEN1LMNACYP1A2GAA
SCHEMBL426545 0.81 KMT2A (0.58) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1
SCHEMBL1133966 0.81 KMT2A (0.58) KMT2AMEN1HSD17B10SMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9951001-B2 Hepatoprotectant acetaminophen mutual prodrugs ACORDA THERAPEUTICS, INC. (US) 2018-04-24 US disclosed
US-9951001-B2 Hepatoprotectant acetaminophen mutual prodrugs ACORDA THERAPEUTICS, INC. (US) 2018-04-24 US disclosed
US-20160326107-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS NEUROGESX, INC. 2016-11-10 US disclosed
US-20160326107-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS NEUROGESX, INC. 2016-11-10 US disclosed
US-20110263545-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS ACORDA THERAPEUTICS, INC. 2011-10-27 US disclosed
US-20110263545-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS ACORDA THERAPEUTICS, INC. 2011-10-27 US disclosed
CN-102149412-A Hepatoprotectant acetaminophen mutual prodrugs NEUROGESX INC 2011-08-10 CN disclosed
EP-2285419-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS Neurogesx, Inc. (US) 2011-02-23 EP disclosed
WO-2009143299-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS NEUROGESX, INC. (US) 2009-11-26 WO disclosed
WO-2009143299-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS NEUROGESX, INC. (US) 2009-11-26 WO 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-20160326107-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS PTGS1, HPGD, PYGL KMT2A 4597/4885MEN1 4430/4885HSD17B10 463/4885
US-20110263545-A1 HEPATOPROTECTANT ACETAMINOPHEN MUTUAL PRODRUGS PTGS1, HPGD, PYGL KMT2A 4597/4885MEN1 4430/4885HSD17B10 463/4885

“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.