SCHEMBL2852646

SCHEMBL2852646

CCN(CCN)c1nccs1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SCN1A P35498 1/20 0.40
SCN2A Q99250 1/20 0.40
SCN3A Q9NY46 1/20 0.40
HTR7 P34969 1/20 0.35
ALDH1A1 P00352 1/20 0.34
TSHR P16473 1/20 0.34
NOS1 P29475 1/20 0.34
HSD17B10 Q99714 1/20 0.34
FBP1 P09467 1/20 0.33
LOXL2 Q9Y4K0 1/20 0.33
CARM1 Q86X55 1/20 0.32
PRMT1 Q99873 1/20 0.32
TMPRSS15 P98073 3/20 0.31
AOC3 Q16853 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
SCHEMBL24743388 0.88 SCN1A (0.40) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL4720415 0.85 SCN1A (0.42) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL4722623 0.85 SCN1A (0.43) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL4723376 0.82 SCN1A (0.40) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL14102679 0.79 SCN1A (0.45) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL2858049 0.78 HTR7 (0.41) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL4724814 0.77 SCN1A (0.44) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL4722034 0.74 SCN1A (0.42) SCN1ASCN2ASCN3AHTR7ALDH1A1
SCHEMBL2226558 0.73
SCHEMBL4894844 0.73 SCN1A (0.41) SCN1ASCN2ASCN3AHTR7ALDH1A1

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
EP-1968957-B1 SUBSTITUTED THIAZOLES AND THEIR USE FOR PRODUCING DRUGS GRUENENTHAL GMBH (DE) 2010-01-20 EP disclosed
US-20090176756-A1 SUBSTITUTED THIAZOLES AND THEIR USE FOR PRODUCING DRUGS GRUNENTHAL GMBH (DE) 2009-07-09 US disclosed
WO-2007079960-A9 SUBSTITUTED THIAZOLES AND THEIR USE FOR PRODUCING DRUGS GRUENENTHAL GMBH (DE) 2008-10-23 WO disclosed
EP-1968957-A1 SUBSTITUTED THIAZOLES AND THEIR USE FOR PRODUCING DRUGS Grünenthal GmbH (DE) 2008-09-17 EP disclosed
WO-2007079960-A1 SUBSTITUTED THIAZOLES AND THEIR USE FOR PRODUCING DRUGS Grünenthal GmbH (DE) 2007-07-19 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-20090176756-A1 SUBSTITUTED THIAZOLES AND THEIR USE FOR PRODUCING DRUGS TPMT, SLC5A2, DPP4 SCN1A 3301/4885SCN2A 2668/4885SCN3A 2429/4885

“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.