SCHEMBL2139696

SCHEMBL2139696

CSc1nsc(NC(=O)c2cc(C3CCCN3C(=O)OC(C)(C)C)sc2C)n1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
NPSR1 Q6W5P4 2/20 0.39
LMNA P02545 2/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 3/20 0.36
GAA P10253 1/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.36
SCN5A Q14524 1/20 0.36
SCN3A Q9NY46 1/20 0.36
USP30 Q70CQ3 1/20 0.36
SCN4A P35499 1/20 0.35
MAPT P10636 1/20 0.35
MAOA P21397 2/20 0.35
PTGES O14684 2/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL2708164 0.89 RAB9A (0.39) L3MBTL1LMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL2137428 0.87 L3MBTL1 (0.45) L3MBTL1NPSR1LMNARAB9ASMN1; SMN2
SCHEMBL2137940 0.86 L3MBTL1 (0.44) L3MBTL1NPSR1LMNASMN1; SMN2ALDH1A1
SCHEMBL2135766 0.82 L3MBTL1 (0.45) L3MBTL1NPSR1LMNAALDH1A1GAA
SCHEMBL2135903 0.81 HTT (0.46) L3MBTL1NPSR1LMNARAB9ASMN1; SMN2
SCHEMBL2139521 0.80 L3MBTL1 (0.44) L3MBTL1NPSR1LMNAALDH1A1GAA
SCHEMBL2136182 0.80 L3MBTL1 (0.44) L3MBTL1NPSR1LMNAALDH1A1GAA
SCHEMBL2137255 0.77 NPSR1 (0.43) L3MBTL1NPSR1LMNASMN1; SMN2ALDH1A1
SCHEMBL2139057 0.76 HSD17B10 (0.44) L3MBTL1NPSR1LMNASMN1; SMN2ALDH1A1
SCHEMBL2134276 0.73 MAOA (0.35) L3MBTL1ALDH1A1MEN1KMT2ANPC1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120101137-A1 NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF SANWA KAGAKU KENKYUSHO CO., LTD. (JP) 2012-04-26 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-20120101137-A1 NOVEL THIOPHENECARBOXAMIDE DERIVATIVE AND PHARMACEUTICAL USE THEREOF GCK, GCKR, HK2 L3MBTL1 4632/4885NPSR1 2520/4885LMNA 4539/4885

“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.