SCHEMBL9629429

SCHEMBL9629429

CCOC1=CC(=O)c2cc(C)c(C)cc2C1=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 2/20 0.49
PTPRC P08575 2/20 0.49
GAPDH P04406 2/20 0.39
IDO1 P14902 1/20 0.37
CDC25A P30304 1/20 0.37
NQO1 P15559 3/20 0.35
POR P16435 3/20 0.35
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
ALDH1A1 P00352 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
S100A4 P26447 1/20 0.32
ACHE P22303 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL9714130 0.86 ELANE (0.38) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL23271788 0.84 CDC25B (0.47) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9629332 0.81 CDC25B (0.49) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9627491 0.81 CDC25B (0.53) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL8582314 0.79 IDO1 (0.58) CDC25BGAPDHIDO1CDC25AMAPT
SCHEMBL30004088 0.79 IDO1 (0.58) CDC25BGAPDHIDO1CDC25AMAPT
SCHEMBL9713600 0.78 CDC25B (0.53) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9628401 0.77 PTPRC (0.51) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9627545 0.77 CDC25B (0.51) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9629343 0.77 CDC25B (0.51) CDC25BPTPRCIDO1CDC25ACTDSP1

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 7 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-5134161-A Enzyme inhibitors for skin disorders, antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-07-28 US disclosed
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
US-4786652-A TOPICAL ADMINISTRATION SYNTEX (U.S.A.) INC. (US) 1988-11-22 US disclosed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282006-A1 Naphtalene 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