SCHEMBL19983360

SCHEMBL19983360

OCc1cc2c(cc1CO)C2

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIA1 P42261 1/20 0.39
GRIA2 P42262 1/20 0.39
GRIA3 P42263 1/20 0.39
GRIA4 P48058 1/20 0.39
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 1/20 0.31
CASP6 P55212 1/20 0.31
SHBG P04278 1/20 0.30

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
SCHEMBL16140056 0.82 GRIA1 (0.41) GRIA1GRIA2GRIA3GRIA4PDE4A
SCHEMBL16140059 0.78 GRIA1 (0.39) GRIA1GRIA2GRIA3GRIA4KDM4E
SCHEMBL12354602 0.77 CYP2A6 (0.43) GRIA1GRIA2GRIA3GRIA4CYP3A4
SCHEMBL672601 0.75 GRIA1 (0.48) GRIA1GRIA2GRIA3GRIA4PDE4A
SCHEMBL16140063 0.75 GRIA1 (0.36) GRIA1GRIA2GRIA3GRIA4PDE4A
SCHEMBL6985794 0.75 GRIA1 (0.34) GRIA1GRIA2GRIA3GRIA4PDE4A
SCHEMBL13241079 0.71 CYP2C19 (0.50) GRIA1GRIA2GRIA3GRIA4PDE4A
SCHEMBL7854609 0.71 FYN (0.56) GRIA1GRIA2GRIA3GRIA4PDE4A
SCHEMBL6848672 0.71 GRIA1 (0.37) GRIA1GRIA2GRIA3GRIA4KDM4E
SCHEMBL15202657 0.67

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-2018049465-A1 METHOD OF RETARDING AN ETHYLENE RESPONSE CURTIN UNIVERSITY OF TECHNOLOGY (AU) 2018-03-22 WO disclosed