SCHEMBL3405545

SCHEMBL3405545

Cc1nc(-c2cc(Cl)cc(Cl)c2)sc1C(=O)NCCN1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 2/20 0.50
GAA P10253 2/20 0.46
ALDH1A1 P00352 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
STAT3 P40763 2/20 0.45
HSD17B10 Q99714 1/20 0.44
NPC1 O15118 1/20 0.44
HPGD P15428 1/20 0.44
PPARA Q07869 2/20 0.44
SCN9A Q15858 1/20 0.43
DRD2 P14416 1/20 0.43

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
SCHEMBL3405210 0.99 CHRM4 (0.51) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3400864 0.93 GAA (0.50) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3400078 0.92 CHRM4 (0.49) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL14545337 0.90 CHRM4 (0.48) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3406027 0.87 CHRM4 (0.50) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3401256 0.86 GAA (0.47) CHRM4GAANPSR1STAT3NPC1
SCHEMBL3396893 0.86 SCN9A (0.48) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3399568 0.85 CHRM4 (0.51) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3399475 0.85 CHRM4 (0.51) CHRM4GAAALDH1A1SMN1; SMN2NPSR1
SCHEMBL3400929 0.85 SCN9A (0.49) CHRM4GAASMN1; SMN2NPSR1NPC1

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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues LIGAND PHARMACEUTICALS, INC. (US) 2010-11-25 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
US-7728009-B1 Thiazole amides, imidazole amides and related analogues NEUROGEN CORPORATION (US) 2010-06-01 US disclosed
WO-2006089076-A9 THIAZOLE AMIDES, IMIDAZOLE AMIDES AND RELATED ANALOGUES NEUROGEN CORP (US) 2007-04-26 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-20100297035-A1 Thiazole Amides, Imidazole Amides and Related Analogues HRH3, HRH4, HRH2 CHRM4 289/4885GAA 1659/4885ALDH1A1 916/4885

“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.