SCHEMBL9627475

SCHEMBL9627475

COc1cc(O)c2c(OC)cccc2c1OC(C)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 1/20 0.49
MAPT P10636 5/20 0.47
GAA P10253 4/20 0.47
HTT P42858 2/20 0.47
KDM4E B2RXH2 2/20 0.47
TP53 P04637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
ANTXR2 P58335 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KMT2A Q03164 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 1/20 0.45
MCL1 Q07820 1/20 0.45
HIF1A Q16665 1/20 0.45
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43

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
SCHEMBL9627528 0.87 HTT (0.48) CTSVMAPTGAAHTTKDM4E
SCHEMBL9627929 0.84 BACE1 (0.50) CTSVMAPTGAAHTTKDM4E
SCHEMBL9628320 0.83 MAPT (0.67) MAPTGAAHTTKDM4ETP53
SCHEMBL9641706 0.80 ABCB11 (0.53) MAPTGAAHTTKDM4EHSD17B10
SCHEMBL9660612 0.78 HTT (0.52) CTSVMAPTGAAHTTKDM4E
SCHEMBL9629327 0.77 HTT (0.44) CTSVMAPTGAAHTTKDM4E
SCHEMBL11077979 0.77 MAPT (0.63) MAPTGAAHTTKDM4ETP53
SCHEMBL9628509 0.77 PTPN1 (0.45) MAPTGAAHTTKDM4EHSD17B10
SCHEMBL9627702 0.77 CTSV (0.40) CTSVMAPTGAAKDM4EANTXR2
SCHEMBL9628374 0.77 HTT (0.43) MAPTGAAHTTKDM4ETP53

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-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282006-A1 Naphtalene 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