SCHEMBL9714130

SCHEMBL9714130

CCCOC1=CC(=O)c2cc(C)c(C)cc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.38
GAPDH P04406 1/20 0.37
CDC25B P30305 2/20 0.36
PTPRC P08575 1/20 0.36
IDO1 P14902 1/20 0.35
CDC25A P30304 1/20 0.35
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
PTPN1 P18031 2/20 0.33
NQO1 P15559 2/20 0.33
POR P16435 2/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.32
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
ALDH1A1 P00352 1/20 0.32
GAA P10253 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL9629429 0.86 CDC25B (0.49) GAPDHCDC25BPTPRCIDO1CDC25A
SCHEMBL11106678 0.83 GAPDH (0.57) ELANEGAPDHCDC25BPTPRCIDO1
SCHEMBL9713511 0.78 S100A4 (0.41) GAPDHCDC25BPTPRCIDO1CDC25A
SCHEMBL9628358 0.78 CDC25B (0.61) GAPDHCDC25BPTPRCIDO1CDC25A
SCHEMBL8582314 0.77 IDO1 (0.58) GAPDHCDC25BIDO1CDC25AMAPT
SCHEMBL30004088 0.77 IDO1 (0.58) GAPDHCDC25BIDO1CDC25AMAPT
SCHEMBL9714028 0.74 CDC25B (0.42) GAPDHCDC25BPTPRCIDO1CDC25A
SCHEMBL11252366 0.73 PTPRC (0.38) CDC25BPTPRCMAPTPTPN1MEN1
SCHEMBL28724662 0.73 GAPDH (0.53) GAPDHCDC25BPTPRCIDO1CDC25A
SCHEMBL23271788 0.71 CDC25B (0.47) GAPDHCDC25BPTPRCIDO1CDC25A

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