SCHEMBL9628401

SCHEMBL9628401

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRC P08575 3/20 0.51
CDC25B P30305 2/20 0.51
S100A4 P26447 1/20 0.43
BCL2 P10415 2/20 0.41
MCL1 Q07820 1/20 0.41
IDO1 P14902 1/20 0.40
CDC25A P30304 1/20 0.40
SMAD3 P84022 2/20 0.39
APAF1 O14727 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
TSHR P16473 3/20 0.37
HPGD P15428 1/20 0.37
KDM1A O60341 1/20 0.37
STK17B O94768 1/20 0.37
CTDSP1 Q9GZU7 1/20 0.36
KMT2A Q03164 1/20 0.36
ESR1 P03372 1/20 0.36
GAPDH P04406 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL9713600 0.83 CDC25B (0.53) PTPRCCDC25BIDO1CDC25ATSHR
SCHEMBL9627491 0.83 CDC25B (0.53) PTPRCCDC25BS100A4IDO1CDC25A
SCHEMBL9388961 0.82 IDO1 (0.61) PTPRCCDC25BS100A4BCL2MCL1
SCHEMBL9629343 0.81 CDC25B (0.51) PTPRCCDC25BS100A4IDO1CDC25A
SCHEMBL9627545 0.81 CDC25B (0.51) PTPRCCDC25BIDO1CDC25ACES2
SCHEMBL9627607 0.80 CDC25B (0.50) PTPRCCDC25BIDO1CDC25ATSHR
SCHEMBL11252090 0.80 CDC25B (0.50) PTPRCCDC25BIDO1CDC25AAPAF1
SCHEMBL29800450 0.78 CDC25B (0.74) PTPRCCDC25BS100A4IDO1CDC25A
SCHEMBL2511730 0.78 CDC25B (0.74) PTPRCCDC25BS100A4IDO1CDC25A
SCHEMBL9628723 0.78 PTPRC (0.55) PTPRCCDC25BIDO1CDC25ASMAD3

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-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