SCHEMBL9304867

SCHEMBL9304867

CC(O)(c1ccc2c(c1)OCO2)C(n1cncn1)[Si](C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP26A1 O43174 2/20 0.47
MGLL Q99685 5/20 0.45
FAAH O00519 2/20 0.45
MAPT P10636 4/20 0.35
ALDH1A1 P00352 2/20 0.35
RECQL P46063 2/20 0.35
PGR P06401 1/20 0.34
AR P10275 1/20 0.34
GABRA1 P14867 1/20 0.34
MAOA P21397 1/20 0.34
SLC6A2 P23975 1/20 0.34
PDE4A P27815 1/20 0.34
KDR P35968 1/20 0.34
GABRB2 P47870 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HSP90AA1 P07900 3/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTT P42858 2/20 0.33

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
SCHEMBL5470952 0.68 CYP3A4 (0.50) HSP90AA1CYP3A4LMNACYP19A1
SCHEMBL8758047 0.68 MGLL (0.44) CYP26A1MGLLFAAHMAPTALDH1A1
SCHEMBL933157 0.68 CYP3A4 (0.50) MAPTALDH1A1RECQLPGRAR
SCHEMBL8927137 0.68 MEN1 (0.52) CYP26A1MAPTALDH1A1HSP90AA1KMT2A
SCHEMBL8926476 0.68 CYP26A1 (0.43) CYP26A1MAPTALDH1A1SLC6A2SLC6A3
SCHEMBL30567467 0.64 ALDH1A1 (0.52) MAPTALDH1A1RECQLPGRAR
SCHEMBL85405 0.64 ALDH1A1 (0.52) MAPTALDH1A1RECQLPGRAR
SCHEMBL1746001 0.64 CYP3A4 (0.46) MAPTALDH1A1RECQLPGRAR
SCHEMBL1085019 0.63 HPGD (0.49) MGLLMAPTALDH1A1RECQLGABRA1
SCHEMBL9150315 0.63 CYP3A4 (0.44) MAPTALDH1A1RECQLPGRAR

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
US-5306712-A Administering to plants and animals SANYO COMPANY, LIMITED (JP) 1994-04-26 US disclosed