SCHEMBL5438592

SCHEMBL5438592

COc1ccc(-c2nc(SCCNC(=O)c3ccco3)[nH]c2-c2ccc(OC)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GFER P55789 1/20 0.55
MAPT P10636 4/20 0.53
HTT P42858 1/20 0.53
TP53 P04637 2/20 0.52
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
PPARG P37231 1/20 0.46
NCOA2 Q15596 1/20 0.46
NCOA1 Q15788 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPK14 Q16539 1/20 0.46

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
SCHEMBL5489959 0.85 ALDH1A1 (0.57) MAPTTP53NPC1RAB9AKMT2A
SCHEMBL5485404 0.83 MTNR1A (0.56) MAPK14
SCHEMBL5454945 0.83 KDM4E (0.51) MAPTTP53NPC1KMT2AMEN1
SCHEMBL5441827 0.82 MEN1 (0.47) KMT2AMEN1ALDH1A1HPGDPPARG
SCHEMBL5482907 0.82 ALDH1A1 (0.61) MAPTTP53NPC1RAB9AKMT2A
SCHEMBL5444933 0.81 TP53 (0.52) MAPTTP53RAB9AKMT2AMEN1
SCHEMBL5465396 0.81 SMN1; SMN2 (0.53) GFERMAPTTP53NPC1RAB9A
SCHEMBL5435574 0.81 SMN1; SMN2 (0.54) MAPTTP53NPC1RAB9AKMT2A
SCHEMBL5449294 0.81 HPGD (0.48) MAPTNPC1RAB9AKMT2AMEN1
SCHEMBL5481935 0.81 MAPK14 (0.48) MAPTHPGDSMN1; SMN2MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070185169-A1 2-Mercapto-4,5-Diarylimidazole Derivatives and the use thereof as Cyclooxygenase Inhibitors BEIERSDORF, AG 2007-08-09 US disclosed
US-7223781-B2 2-mercapto-4,5-diarylimidazole derivatives and the use thereof as cyclooxygenase inhibitors BEIERSDORF AG (DE) 2007-05-29 US disclosed
US-20040116695-A1 2-Mercapto-4,5-diarylimidazole derivatives and the use thereof as cyclooxygenase inhibitors BEIERSDORF AG (DE) 2004-06-17 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-20070185169-A1 2-Mercapto-4,5-Diarylimidazole Derivatives and the use thereof as Cyclooxygenase Inhibitors PTGS2, PTGES2, DHFR GFER 322/4885MAPT 4634/4885HTT 4837/4885

“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.