SCHEMBL9628240

SCHEMBL9628240

CCOc1c(OC)cc(O)c2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.56
TUBB1 Q9H4B7 2/20 0.44
MPL P40238 1/20 0.44
SYK P43405 1/20 0.43
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
SLC2A1 P11166 1/20 0.42
TP53 P04637 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
TSHR P16473 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
ALOX5 P09917 3/20 0.41
PTGES O14684 1/20 0.41
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 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
SCHEMBL9627146 0.90 SLC2A1 (0.50) EP300TUBB1SLC2A1TP53TSHR
SCHEMBL9628341 0.87 EP300 (0.53) EP300TUBB1MPLTP53CA1
SCHEMBL9628147 0.87 EP300 (0.51) EP300TUBB1SYKSLC2A1TP53
SCHEMBL9628286 0.84 EP300 (0.65) EP300TUBB1MPLTP53CA1
SCHEMBL30504004 0.83 SYK (0.52) TUBB1SYKHTR2AHTR2CHTR2B
SCHEMBL19612386 0.83 SYK (0.52) TUBB1SYKHTR2AHTR2CHTR2B
SCHEMBL9627505 0.78 EP300 (0.50) EP300MPLTP53ALOX5PTGES
SCHEMBL9657859 0.77 LMNA (0.50) EP300TP53ALOX5KDM4EALDH1A1
SCHEMBL29700360 0.77 LMNA (0.50) EP300TP53ALOX5KDM4EALDH1A1
SCHEMBL9627686 0.77 SLC2A1 (0.46) EP300HTR2BSLC2A1ALOX5KDM4E

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 5 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-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 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