SCHEMBL9713600

SCHEMBL9713600

CCOC1=CC(=O)c2cc(OCC)ccc2C1=O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25B P30305 2/20 0.53
PTPRC P08575 1/20 0.53
MAPT P10636 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAPDH P04406 1/20 0.42
HSD17B10 Q99714 2/20 0.41
ESR2 Q92731 1/20 0.41
IDO1 P14902 1/20 0.41
CDC25A P30304 1/20 0.41
KMT2A Q03164 3/20 0.41
CHRNA7 P36544 1/20 0.41
NQO1 P15559 1/20 0.41
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
KDM4E B2RXH2 1/20 0.40
TSHR P16473 1/20 0.40
CA12 O43570 1/20 0.40

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
SCHEMBL11252090 0.91 CDC25B (0.50) CDC25BPTPRCMAPTL3MBTL1GAPDH
SCHEMBL9628193 0.91 CDC25B (0.54) CDC25BPTPRCMAPTL3MBTL1GAPDH
SCHEMBL11252510 0.84 GAPDH (0.50) CDC25BPTPRCMAPTL3MBTL1GAPDH
SCHEMBL9627491 0.84 CDC25B (0.53) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9627540 0.83 MAPT (0.49) CDC25BPTPRCMAPTL3MBTL1HSD17B10
SCHEMBL9627545 0.83 CDC25B (0.51) CDC25BPTPRCMAPTL3MBTL1GAPDH
SCHEMBL9628401 0.83 PTPRC (0.51) CDC25BPTPRCGAPDHIDO1CDC25A
SCHEMBL9629343 0.83 CDC25B (0.51) CDC25BPTPRCIDO1CDC25AGAA
SCHEMBL9627607 0.81 CDC25B (0.50) CDC25BPTPRCMAPTL3MBTL1GAPDH
SCHEMBL10883121 0.81 MAPT (0.70) PTPRCMAPTL3MBTL1HSD17B10ESR2

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-5091558-A Topical administeration SYNTEX (U.S.A.) INC. (US) 1992-02-25 US disclosed
EP-0150831-B1 NAPHTHALENE ANTI-PSORIATIC AGENTS SYNTEX (U.S.A.) INC. (US) 1988-08-10 EP disclosed
EP-0150831-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1985-08-07 EP disclosed