SCHEMBL1679967

SCHEMBL1679967

NC(=O)C(S)CCCCCCCCC(S)C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RNPEP Q9H4A4 2/20 0.50
CPB2 Q96IY4 3/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
FOLH1 Q04609 2/20 0.33
MAPT P10636 1/20 0.33
GSTK1 Q9Y2Q3 1/20 0.32
ENPEP Q07075 1/20 0.32
NOS2 P35228 1/20 0.31
EPHX1 P07099 2/20 0.31
GSR P00390 1/20 0.31
ALDH1A1 P00352 1/20 0.30
GPR84 Q9NQS5 3/20 0.30
FFAR1 O14842 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
SCHEMBL5456827 0.92 RNPEP (0.46) RNPEPCPB2CA1CA2FOLH1
SCHEMBL27603467 0.91 RNPEP (0.43) RNPEPCPB2CA1CA2FOLH1
SCHEMBL5053854 0.89 MAPT (0.50) CA1CA2MAPTEPHX1GPR84
SCHEMBL18151523 0.89 MAPT (0.50) CA1CA2MAPTEPHX1GPR84
SCHEMBL18151863 0.89 MAPT (0.50) CA1CA2MAPTEPHX1GPR84
SCHEMBL3722099 0.89 MAPT (0.50) CA1CA2MAPTEPHX1GPR84
SCHEMBL18756515 0.87 RNPEP (0.68) RNPEPCPB2FOLH1GSRALDH1A1
Hydrochloric Acid SCHEMBL29263417 0.87 MAPT (0.48) CA1CA2MAPTEPHX1GPR84
SCHEMBL18151527 0.85 CA1 (0.48) RNPEPCA1CA2MAPTEPHX1
SCHEMBL5469952 0.85 RNPEP (0.39) RNPEPCA1CA2FOLH1MAPT

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-9701629-B2 Use of dithiocarbamate esters and bis-dithiocarbamate esters in the preparation of organic-inorganic nanocomposites SONY DEUTSCHLAND GMBH (DE) 2017-07-11 US disclosed
US-RE44510-E1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2013-09-24 US disclosed
US-8173842-B2 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2012-05-08 US disclosed
US-7923576-B2 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2011-04-12 US disclosed
EP-1215205-B1 Tuned multifunctional linker molecules for electronic charge transport through organic-inorganic composite structures and use thereof SONY DEUTSCHLAND GMBH (DE) 2007-11-21 EP disclosed
US-20060163564-A1 Use of dithiocarbamate esters and bis-dithiocarbamate esters in the preparation of organic-inorganic nanocomposites SONY DEUTSCHLAND GMBH (DE) 2006-07-27 US disclosed
US-20060138408-A1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2006-06-29 US disclosed
US-20060113530-A1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2006-06-01 US disclosed
US-7030271-B2 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY INTERNATIONAL (EUROPE) GMBH (DE) 2006-04-18 US disclosed
US-20020127756-A1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof SONY DEUTSCHLAND GMBH (DE) 2002-09-12 US disclosed
EP-1215205-A1 Tuned multifunctional linker molecules for electronic charge transport through organic-inorganic composite structures and use thereof Sony International (Europe) GmbH (DE) 2002-06-19 EP 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 (4 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-20060163564-A1 Use of dithiocarbamate esters and bis-dithiocarbamate esters in the preparation of organic-inorganic nanocomposites KCNC1, VDAC1, CALCOCO2 RNPEP 4527/4885CPB2 1541/4885CA1 561/4885
US-20060138408-A1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof CORO1C, EXOC1, CLINT1 RNPEP 4492/4885CPB2 1358/4885CA1 778/4885
US-20060113530-A1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof CORO1C, CALCOCO2, KCNC1 RNPEP 4463/4885CPB2 1314/4885CA1 825/4885
US-20020127756-A1 Multifunctional linker molecules for tuning electronic charge transport through organic-inorganic composite structures and uses thereof CORO1C, CACNG2, KCNC1 RNPEP 4661/4885CPB2 1575/4885CA1 867/4885

“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.