SCHEMBL5155653

SCHEMBL5155653

[NH]C(=O)CN1CCSCC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.38
KDM4E B2RXH2 4/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.35
GAA P10253 2/20 0.34
PKM P14618 1/20 0.34
FAAH O00519 1/20 0.33
PHGDH O43175 1/20 0.33
MGLL Q99685 1/20 0.33
NPC1 O15118 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
ARG1 P05089 1/20 0.33
ARG2 P78540 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4768884 0.78 HSD17B10 (0.52) ALDH1A1KDM4ELMNAHTTGAA
SCHEMBL6445312 0.78 ALDH1A1 (0.39) ALDH1A1KDM4ELMNAHTTGAA
SCHEMBL1259117 0.77
SCHEMBL1259865 0.77
SCHEMBL8267015 0.76 LMNA (0.40) ALDH1A1KDM4ELMNAHTTGAA
Hydrochloric Acid SCHEMBL1371867 0.76 HSD17B10 (0.50) ALDH1A1KDM4ELMNAHTTGAA
SCHEMBL2106140 0.76 KDM4E (0.56) ALDH1A1KDM4ELMNAHTTGAA
SCHEMBL1258251 0.75 GAA (0.56) ALDH1A1KDM4EHTTGAANPC1
SCHEMBL5272886 0.74 ALDH1A1 (0.37) ALDH1A1KDM4ELMNAHTTGAA
SCHEMBL13671235 0.73 LMNA (0.38) ALDH1A1KDM4ELMNAHTTGAA

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
JP-2002512230-A 2002-04-23 JP claimed
EP-1071668-A1 5-AMINOINDENO(1,2-C)PYRAZOL-4-ONES AS ANTI-CANCER AND ANTI-PROLIFERATIVE AGENTS Du Pont Pharmaceuticals Company (US) 2001-01-31 EP claimed
WO-1999054308-A1 5-AMINOINDENO(1,2-C)PYRAZOL-4-ONES AS ANTI-CANCER AND ANTI-PROLIFERATIVE AGENTS DU PONT PHARMACEUTICALS COMPANY (US) 1999-10-28 WO claimed
EP-0678503-B1 Delta-amino-gamma-hydroxy-omega-aryl alkanoic acid amides with enzyme especially renin inhibiting activities NOVARTIS AG (CH) 1999-09-01 EP claimed
US-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-01-18 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-20070015759-A1 Metasubstituted thiazolidinones, their manufacture and use as a drug PLK4, PDXK, PLK2 ALDH1A1 997/4885KDM4E 2470/4885LMNA 2365/4885

“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.