SCHEMBL29327244

SCHEMBL29327244

CCc1cc(-c2cc(C)c(OCC3CO3)c(C)c2)cc(C)c1OCC1CO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
GLA P06280 1/20 0.41
TP53 P04637 3/20 0.40
TSHR P16473 3/20 0.40
HIF1A Q16665 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP3A4 P08684 1/20 0.40
TDP1 Q9NUW8 1/20 0.38
MAPT P10636 2/20 0.36
HPGD P15428 2/20 0.36
PKM P14618 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
PPARG P37231 1/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
VDR P11473 1/20 0.34
S1PR1 P21453 5/20 0.32
S1PR3 Q99500 4/20 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
SCHEMBL2831306 0.90 ALDH1A1 (0.44) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL13117147 0.88 ALDH1A1 (0.50) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL49658 0.88 ALDH1A1 (0.50) ALDH1A1GLATP53TSHRHIF1A
Water SCHEMBL7640555 0.87 ALDH1A1 (0.49) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL8926106 0.84 ALDH1A1 (0.33) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL24842054 0.83 ALDH1A1 (0.46) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL1627011 0.83 ALDH1A1 (0.39) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL13931284 0.82 ALDH1A1 (0.45) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL1235711 0.81 CA1 (0.47) ALDH1A1GLATP53TSHRHIF1A
SCHEMBL1108324 0.81 ALDH1A1 (0.44) 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-2024151049-A1 RESIN COMPOSITION FOR ENCAPSULATING ELECTRONIC DEVICE, AND ELECTRONIC DEVICE MANUFACTURED USING SAME 동우화인켐 주식회사 2024-07-18 WO disclosed