SCHEMBL5732399

SCHEMBL5732399

CC(C(=O)O)c1nc(-c2ccc(F)cc2)c(-c2ccc(S(C)(=O)=O)cc2)o1

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 17/20 0.62
PTGS1 P23219 4/20 0.62
MAPK14 Q16539 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
SCHEMBL5732860 1.00 PTGS2 (0.62) PTGS2PTGS1MAPK14
SCHEMBL6000535 0.91 PTGS2 (0.63) PTGS2PTGS1
SCHEMBL5761173 0.90 PTGS2 (0.61) PTGS2PTGS1
SCHEMBL7504997 0.90 PTGS2 (0.63) PTGS2PTGS1MAPK14
SCHEMBL9029716 0.85 PTGS2 (0.59) PTGS2PTGS1
SCHEMBL7503544 0.82 PTGS2 (0.64) PTGS2PTGS1
SCHEMBL5089153 0.82 PTGS2 (0.55) PTGS2PTGS1
SCHEMBL7506102 0.81 NR4A2 (0.65) PTGS2PTGS1
SCHEMBL6002469 0.80 PTGS2 (0.50) PTGS2PTGS1
SCHEMBL5823861 0.80 PTGS2 (0.50) PTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060251689-A1 Treatment or prevention of pruritus ASTION DEVELOPMENT A/S 2006-11-09 US claimed
US-20060229347-A1 Treatment of eczemas ASTION DEVELOPMENT A/S 2006-10-12 US claimed
WO-2006102899-A2 OXAPROZIN OR CLOSELY RELATED COMPOUND FOR THE TREATMENT AND PREVENTION OF ASTION PHARMA A/S (DK) 2006-10-05 WO claimed
WO-2006102898-A2 OXAPROZIN OR A CLOSELY RELATED COMPOUND FOR THE TREATMENT OF ECZEMA ASTION PHARMA A/S (DK) 2006-10-05 WO claimed
WO-2006102900-A1 DERMATOLOGICAL COMPOSITIONS AND SALTS FOR THE TREATMENT OF DERMATOLOGICAL DISEASES ASTION PHARMA A/S (DK) 2006-10-05 WO claimed
US-20060222671-A1 Dermatological compositions and salts for the treatment of dermatological diseases ASTION DEVELOPMENT A/S 2006-10-05 US claimed
EP-1707200-A1 Dermatological compositions comprising oxaprozin or a closely related compound for the treatment of dermatological diseases Astion Development A/S (DK) 2006-10-04 EP claimed
EP-1707199-A1 Oxaprozin or closely related compound for the treatment and prevention of pruritus Astion Development A/S (DK) 2006-10-04 EP claimed
EP-1707201-A1 Oxaprozin or a closely related compound for the treatment of eczema Astion Development A/S (DK) 2006-10-04 EP claimed
US-20060251689-A1 Treatment or prevention of pruritus ASTION DEVELOPMENT A/S 2006-11-09 US disclosed
US-20060229347-A1 Treatment of eczemas ASTION DEVELOPMENT A/S 2006-10-12 US disclosed
WO-2006102899-A2 OXAPROZIN OR CLOSELY RELATED COMPOUND FOR THE TREATMENT AND PREVENTION OF ASTION PHARMA A/S (DK) 2006-10-05 WO disclosed
WO-2006102898-A2 OXAPROZIN OR A CLOSELY RELATED COMPOUND FOR THE TREATMENT OF ECZEMA ASTION PHARMA A/S (DK) 2006-10-05 WO disclosed
WO-2006102900-A1 DERMATOLOGICAL COMPOSITIONS AND SALTS FOR THE TREATMENT OF DERMATOLOGICAL DISEASES ASTION PHARMA A/S (DK) 2006-10-05 WO disclosed
US-20060222671-A1 Dermatological compositions and salts for the treatment of dermatological diseases ASTION DEVELOPMENT A/S 2006-10-05 US disclosed
EP-1707200-A1 Dermatological compositions comprising oxaprozin or a closely related compound for the treatment of dermatological diseases Astion Development A/S (DK) 2006-10-04 EP disclosed
EP-1707199-A1 Oxaprozin or closely related compound for the treatment and prevention of pruritus Astion Development A/S (DK) 2006-10-04 EP disclosed
EP-1707201-A1 Oxaprozin or a closely related compound for the treatment of eczema Astion Development A/S (DK) 2006-10-04 EP disclosed
US-5380738-A Side effect reduction MONSANTO COMPANY (US) 1995-01-10 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 (3 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-20060229347-A1 Treatment of eczemas ZAP70, SYK, LCK PTGS2 792/4885PTGS1 745/4885MAPK14 92/4885
US-20060251689-A1 Treatment or prevention of pruritus ITCH, TSLP, HRH4 PTGS2 169/4885PTGS1 131/4885MAPK14 850/4885
US-20060222671-A1 Dermatological compositions and salts for the treatment of dermatological diseases ZAP70, SYK, LCK PTGS2 1589/4885PTGS1 1534/4885MAPK14 374/4885

“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.