SCHEMBL1362696

SCHEMBL1362696

CN1C(=O)NC(CS)C1=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 6/20 0.42
NPSR1 Q6W5P4 1/20 0.38
TNF P01375 1/20 0.38
GAA P10253 2/20 0.37
MMP1 P03956 8/20 0.36
MMP9 P14780 7/20 0.36
MMP3 P08254 4/20 0.36
MMP7 P09237 2/20 0.33
KMT2A Q03164 1/20 0.32
PLA2G10 O15496 1/20 0.32
PLA2G5 P39877 1/20 0.32
TP53 P04637 1/20 0.30
GLA P06280 1/20 0.30
CYP3A4 P08684 1/20 0.30
MAPT P10636 1/20 0.30
THRB P10828 1/20 0.30
IDO1 P14902 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL16001119 1.00 RIPK1 (0.42) RIPK1NPSR1TNFGAAMMP1
SCHEMBL14687910 0.81 ALDH1A1 (0.41) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL15026061 0.81 ALDH1A1 (0.41) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL22702838 0.81 ALDH1A1 (0.41) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL25404225 0.79 RIPK1 (0.38) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL12049657 0.79 NPSR1 (0.41) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL7687783 0.79 RIPK1 (0.38) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL10159093 0.79 NPSR1 (0.41) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL13799221 0.79 RIPK1 (0.38) RIPK1NPSR1TNFGAAKMT2A
SCHEMBL10159151 0.79 NPSR1 (0.41) RIPK1NPSR1TNFGAAKMT2A

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
US-8066977-B2 Agent for permanent hair waving containing heterocyclic mercapto compound SHOWA DENKO K.K. (JP) 2011-11-29 US disclosed
EP-1883454-B1 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO KK (JP) 2009-11-04 EP disclosed
US-20090208439-A1 Agent for Permanent Hair Waving Containing Heterocyclic Mercapto Compound SHOWA DENKO K.K. (JP) 2009-08-20 US disclosed
EP-1883454-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND Showa Denko K.K. (JP) 2008-02-06 EP disclosed
WO-2006126729-A2 AGENT FOR PERMANENT HAIR WAVING CONTAINING HETEROCYCLIC MERCAPTO COMPOUND SHOWA DENKO K.K. (JP) 2006-11-30 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 (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-20090208439-A1 Agent for Permanent Hair Waving Containing Heterocyclic Mercapto Compound NSD3, WNT3, MSRB3 RIPK1 1216/4885NPSR1 773/4885TNF 4182/4885

“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.