SCHEMBL9629477

SCHEMBL9629477

CCCCCCOc1c(OC)cc(OC(C)=O)c2ccccc12

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.50
ALOX5 P09917 2/20 0.49
PTGS2 P35354 3/20 0.45

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
SCHEMBL9658121 0.92 HTT (0.52) HTTPTGS2
SCHEMBL9628323 0.91 HTT (0.54) HTTALOX5
SCHEMBL9627803 0.90 ALOX5 (0.52) HTTALOX5
SCHEMBL9627400 0.87 HTT (0.56) HTTALOX5PTGS2
SCHEMBL9628087 0.87 HTT (0.56) HTTALOX5PTGS2
SCHEMBL9628363 0.87 HTT (0.55) HTTPTGS2
SCHEMBL9627747 0.86 HTT (0.57) HTTALOX5PTGS2
SCHEMBL9628345 0.85 HTT (0.56) HTTALOX5
SCHEMBL19612401 0.85 SLC2A1 (0.45) HTT
SCHEMBL9660327 0.83 HTT (0.50) HTTALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155132-A Nonsteroidal antiinflammatory agents; treating psoriasis SYNTEX (U.S.A.) INC. (US) 1992-10-13 US disclosed
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed