SCHEMBL9628489

SCHEMBL9628489

COC1=CC(=O)c2ccc(C)cc2C1=O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 2/20 0.62
CDC25B P30305 2/20 0.62
IDO1 P14902 1/20 0.62
MAOA P21397 1/20 0.50
MAOB P27338 1/20 0.50
ELANE P08246 1/20 0.48
S100A4 P26447 1/20 0.48
TDP2 O95551 2/20 0.47
NSD2 O96028 2/20 0.47
GAPDH P04406 2/20 0.45
PTPN1 P18031 1/20 0.44
HKDC1 Q2TB90 3/20 0.44
PDE4D Q08499 1/20 0.43
ALKBH3 Q96Q83 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL9627801 0.93 CDC25A (0.62) CDC25ACDC25BIDO1MAOAMAOB
SCHEMBL5809726 0.82 IDO1 (0.62) CDC25ACDC25BIDO1TDP2NSD2
SCHEMBL9629332 0.81 CDC25B (0.49) CDC25ACDC25BIDO1MAOAMAOB
SCHEMBL15026430 0.81 IDO1 (0.61) CDC25ACDC25BIDO1S100A4TDP2
SCHEMBL7807732 0.81 IDO1 (0.61) CDC25ACDC25BIDO1S100A4TDP2
SCHEMBL30004088 0.79 IDO1 (0.58) CDC25ACDC25BIDO1S100A4TDP2
SCHEMBL8582314 0.79 IDO1 (0.58) CDC25ACDC25BIDO1S100A4TDP2
SCHEMBL9713496 0.79 IDO1 (0.42) CDC25ACDC25BIDO1MAOAMAOB
SCHEMBL29291850 0.79 MAOA (0.40) CDC25ACDC25BIDO1MAOAMAOB
Chimaphilin SCHEMBL30186450 0.77 ALDH1A1 (0.61) CDC25ACDC25BIDO1MAOAMAOB

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 9 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-5049236-A Lignin derived quinonic compound mixtures useful for the delignification of cellulosic materials INSTITUTE OF PAPER SCIENCE AND TECHNOLOGY, INC. (US) 1991-09-17 US disclosed
US-5002634-A Method for the delignification of wood pulp utilizing fused ring quinone compounds prepared from lignin or lignin derived substances INSTITUTE OF PAPER SCIENCE AND TECHNOLOGY, INC. (US) 1991-03-26 US disclosed
US-4786652-A TOPICAL ADMINISTRATION SYNTEX (U.S.A.) INC. (US) 1988-11-22 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