SCHEMBL10114477

SCHEMBL10114477

COOSCCc1csc(NC(=O)c2cc(Cl)cc(OC(C)=O)c2)n1

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 2/20 0.46
CYP3A4 P08684 1/20 0.46
MAPK1 P28482 2/20 0.40
HTT P42858 1/20 0.40
PDE5A O76074 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GCK P35557 1/20 0.39
LMNA P02545 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 2/20 0.37
CPT1A P50416 1/20 0.37
CPT1B Q92523 1/20 0.37
NPC1 O15118 1/20 0.37
HPGD P15428 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37

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
SCHEMBL10131601 0.83 GRM5 (0.47) GRM5CYP3A4MAPK1HTTPDE5A
SCHEMBL10114371 0.82 SCD (0.40) GRM5CYP3A4HTTALDH1A1MAPT
SCHEMBL10114624 0.82 ALDH1A1 (0.46) CYP3A4MAPK1ALDH1A1MAPTLMNA
SCHEMBL4757092 0.70 MAPK1 (0.60) GRM5CYP3A4MAPK1HTTPDE5A
SCHEMBL27713512 0.67 MAPT (0.53) CYP3A4HTTMAPTLMNA
SCHEMBL6918742 0.67 GRM5 (0.73) GRM5CYP3A4
SCHEMBL13081942 0.66 GRM5 (0.55) GRM5CYP3A4ALDH1A1GCKSMN1; SMN2
SCHEMBL13056047 0.66 TAS1R3 (0.57) HTTALDH1A1MAPTLMNASMN1; SMN2
SCHEMBL4938820 0.65 SCD (0.40) GRM5CYP3A4HTTALDH1A1MAPT
SCHEMBL5179585 0.65 AOC3 (0.71) HTTALDH1A1LMNASMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124632-B2 Alkylsulfonyl-substituted thiazolide compounds ROMARK LABORATORIES, L.C. (US) 2012-02-28 US disclosed
US-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS ROMARK LABORATORIES L.C. 2009-02-05 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-20090036467-A1 ALKYLSULFONYL-SUBSTITUTED THIAZOLIDE COMPOUNDS HAVCR2, EIF2AK2, AADAC GRM5 4521/4885CYP3A4 1087/4885MAPK1 3595/4885

“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.