SCHEMBL31312468

SCHEMBL31312468

COc1cc(O)c(C)c(C/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)c1O

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 7/20 0.62
▸ BACE1 P56817 3/20 0.59
▸ PTPN1 P18031 2/20 0.59
▸ MAOB P27338 6/20 0.59
▸ OPRD1 P41143 1/20 0.52
▸ PPARG P37231 1/20 0.51
▸ PPARA Q07869 1/20 0.51
▸ ALOX5 P09917 2/20 0.50
▸ PTGES O14684 1/20 0.50
▸ PTGS1 P23219 1/20 0.50
▸ PTGS2 P35354 1/20 0.50
▸ ELANE P08246 1/20 0.48

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
SCHEMBL18022144 0.84 APP (0.58) APPBACE1PTPN1MAOBOPRD1
SCHEMBL7076824 0.81 MAOB (0.62) APPBACE1PTPN1MAOBPPARG
SCHEMBL15970609 0.79 MAOB (0.77) APPBACE1PTPN1MAOBPPARG
SCHEMBL18093398 0.79 APP (0.71) APPBACE1PTPN1MAOB
SCHEMBL29378933 0.79 APP (0.71) APPBACE1PTPN1MAOB
SCHEMBL4472765 0.79 APP (0.71) APPBACE1PTPN1MAOB
SCHEMBL15970608 0.79 MAOB (0.77) APPBACE1PTPN1MAOBPPARG
SCHEMBL18093396 0.79 APP (0.71) APPBACE1PTPN1MAOB
SCHEMBL31294294 0.79 APP (0.71) APPBACE1PTPN1MAOB
SCHEMBL29928591 0.79 APP (0.71) APPBACE1PTPN1MAOB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024242988-A1 DEVELOPMENT AND APPLICATION OF SYNTHETIC INHIBITORS OF PHOTOSYNTHESIS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2024-11-28 — — WO disclosed
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