SCHEMBL26299286

SCHEMBL26299286

Cc1cc(C(c2cc(C)c(OCC3CO3)c(C)c2)c2ccco2)cc(C)c1OCC1CO1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
GLA P06280 1/20 0.47
TP53 P04637 5/20 0.42
TSHR P16473 3/20 0.42
HIF1A Q16665 2/20 0.42
CYP3A4 P08684 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 4/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
HPGD P15428 3/20 0.35
CYP1A2 P05177 1/20 0.35
PPARG P37231 1/20 0.35
PKM P14618 2/20 0.33
LMNA P02545 2/20 0.33
GAA P10253 1/20 0.33
VDR P11473 1/20 0.32
MAPK1 P28482 2/20 0.31
USP2 O75604 1/20 0.31

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
SCHEMBL24809822 0.90 ALDH1A1 (0.39) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL3677784 0.84 ALDH1A1 (0.46) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL21775754 0.79 ALDH1A1 (0.43) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL9738048 0.78 ALDH1A1 (0.46) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL23627375 0.77 ALDH1A1 (0.41) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL10430018 0.73 ALDH1A1 (0.41) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL3671560 0.72 ALDH1A1 (0.65) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL4470150 0.72 ALDH1A1 (0.50) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL49658 0.72 ALDH1A1 (0.50) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL13117147 0.72 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023176843-A1 LIQUID CRYSTAL DISPLAY ELEMENT SEALANT AND LIQUID CRYSTAL DISPLAY ELEMENT 積水化学工業株式会社 2023-09-21 WO disclosed