SCHEMBL5481419

SCHEMBL5481419

CC(=O)NCCSc1nc(-c2ccc(Cl)cc2)c(-c2ccc(Cl)cc2)[nH]1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.54
PTGS2 P35354 2/20 0.54
KDM4E B2RXH2 3/20 0.48
MAPK14 Q16539 4/20 0.47
LMNA P02545 1/20 0.46
MAPT P10636 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
EGFR P00533 1/20 0.45
PTGES O14684 1/20 0.44

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
SCHEMBL5466784 0.88 KDM4E (0.62) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL5485404 0.86 MTNR1A (0.56) MAPK14
SCHEMBL5434845 0.85 MAPK14 (0.49) KDM4EMAPK14LMNAMAPTHPGD
SCHEMBL5435964 0.84 PTGES (0.55) PTGS1PTGS2KDM4ELMNAMAPT
SCHEMBL5444999 0.83 PTGES (0.57) KDM4ELMNAMAPTHPGDSMN1; SMN2
SCHEMBL5445220 0.82 ALDH1A1 (0.52) MAPTHPGDSMN1; SMN2
SCHEMBL9664403 0.81 KDM4E (0.60) KDM4ELMNAMAPTHPGDSMN1; SMN2
Bromide SCHEMBL11178458 0.80 PTGS1 (0.60) PTGS1PTGS2KDM4EMAPK14
SCHEMBL5471479 0.80 SMN1; SMN2 (0.59) KDM4EMAPTHPGDSMN1; SMN2PTGES
SCHEMBL10963418 0.79 MAPK14 (0.66) PTGS1PTGS2KDM4EMAPK14EGFR

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 PTGS1 4/4885PTGS2 1/4885KDM4E 520/4885

“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.