SCHEMBL8636857

SCHEMBL8636857

C/C(=C\c1cc(C)c(OCC2CO2)c(C)c1)c1cc(C)c(OCC2CO2)c(C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
GLA P06280 1/20 0.40
TP53 P04637 3/20 0.38
TSHR P16473 3/20 0.38
HIF1A Q16665 2/20 0.38
CYP3A4 P08684 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTGS1 P23219 6/20 0.37
PTGS2 P35354 5/20 0.37
ALOX5 P09917 1/20 0.37
NQO1 P15559 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
NQO2 P16083 4/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
CYP1A2 P05177 1/20 0.35
PPARG P37231 1/20 0.35
TUBB1 Q9H4B7 3/20 0.34

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
SCHEMBL8636861 1.00 ALDH1A1 (0.40) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL6235098 0.81 ALDH1A1 (0.46) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL6235094 0.81 ALDH1A1 (0.46) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL10793352 0.80 ALDH1A1 (0.42) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL21838255 0.78 ALDH1A1 (0.44) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL10180321 0.77 ALDH1A1 (0.42) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL3128534 0.76 ALDH1A1 (0.47) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL10350237 0.76 ALDH1A1 (0.45) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL4470150 0.76 ALDH1A1 (0.50) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL49658 0.76 ALDH1A1 (0.50) ALDH1A1GLATP53TSHRHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10298170-A None JP disclosed
JP-H10298170-A EPOXY COMPOUND, ITS PRODUCTION, ITS PURIFICATION, EPOXY RESIN COMPOSITION AND RESIN-SEALED SEMICONDUCTOR DEVICE SUMITOMO CHEM CO LTD 1998-11-10 JP disclosed