SCHEMBL4863223

SCHEMBL4863223

Cc1ccc(/C=C\C=C2\SC(=S)N(CC(=O)O)C2=O)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.80
KMT2A Q03164 4/20 0.80
MEN1 O00255 3/20 0.80
AKR1B1 P15121 3/20 0.80
ALDH1A1 P00352 2/20 0.80
NPC1 O15118 2/20 0.80
PTPN12 Q05209 1/20 0.57
PTPN22 Q9Y2R2 1/20 0.57
LMNA P02545 2/20 0.57
HTT P42858 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.56
MAPK1 P28482 1/20 0.56
ABCC3 O15438 1/20 0.54
ABCC4 O15439 1/20 0.54
AKR1B10 O60218 1/20 0.54
NR1I2 O75469 1/20 0.54
ABCB11 O95342 1/20 0.54
ADRB1 P08588 1/20 0.54
HTR1A P08908 1/20 0.54
ADORA3 P0DMS8 1/20 0.54

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
SCHEMBL7537933 1.00 MAPT (0.80) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL10492259 0.89 MAPT (1.00) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL1315178 0.89 MAPT (1.00) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL6885966 0.88 KMT2A (0.80) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL6886616 0.88 KMT2A (0.80) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL6887177 0.88 MAPT (0.72) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL6886621 0.88 KMT2A (0.80) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL6884868 0.86 KMT2A (0.73) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL6887148 0.86 MAPT (0.73) MAPTKMT2AMEN1AKR1B1ALDH1A1
SCHEMBL10492274 0.86 AKR1B1 (0.77) MAPTKMT2AMEN1AKR1B1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7416744-B2 Extracts, compounds and pharmaceutical compositions having anti-diabetic activity and their use CONOPCO, INC. (US) 2008-08-26 US disclosed
US-20060159779-A1 Extracts, compounds and pharmaceutical compositions having anti-diabetic activity and their use PHYTOPHARM PLC 2006-07-20 US disclosed
EP-1247809-A2 Triazine compounds useful as sorbitol dehydrogenase inhibitors Pfizer Products Inc. (US) 2002-10-09 EP disclosed
US-20010051657-A1 Malonamic acids and derivatives thereof as thyroid receptor ligands PFIZER INC. 2001-12-13 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-20060159779-A1 Extracts, compounds and pharmaceutical compositions having anti-diabetic activity and their use GANAB, HDAC7, NACA MAPT 1434/4885KMT2A 4121/4885MEN1 1570/4885
US-20010051657-A1 Malonamic acids and derivatives thereof as thyroid receptor ligands THRA, MC1R, THRB MAPT 2595/4885KMT2A 3863/4885MEN1 299/4885

“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.