SCHEMBL22245458

SCHEMBL22245458

C(=C/c1cccc(OCC2CO2)c1)\c1ccc(OCC2CO2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.66
TP53 P04637 3/20 0.66
TSHR P16473 3/20 0.66
HIF1A Q16665 2/20 0.66
CYP3A4 P08684 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
TDP1 Q9NUW8 1/20 0.58
LCK P06239 1/20 0.55
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
PKM P14618 2/20 0.48
CYP1A2 P05177 1/20 0.48
PPARG P37231 1/20 0.48
LMNA P02545 1/20 0.48
GAA P10253 1/20 0.48
RELA Q04206 2/20 0.47
TLR4 O00206 2/20 0.45
TLR2 O60603 2/20 0.45

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
SCHEMBL22245459 1.00 ALDH1A1 (0.66) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL22245452 0.94 ALDH1A1 (0.74) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL22245451 0.94 ALDH1A1 (0.74) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL22245431 0.90 ALDH1A1 (0.73) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL22245430 0.90 ALDH1A1 (0.73) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL15899576 0.88 TDP1 (0.71) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL15899575 0.88 TDP1 (0.71) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL14063109 0.87 TDP1 (0.63) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL6813909 0.87 TDP1 (0.63) ALDH1A1TP53TSHRHIF1ACYP3A4
SCHEMBL6813905 0.87 TDP1 (0.63) ALDH1A1TP53TSHRHIF1ACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10723834-B1 Low melting and low viscosity thermoset matrix resins from the Z configuration of polyhydroxy stilbenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2020-07-28 US claimed
US-11118002-B1 Low melting and low viscosity thermoset matrix resins from the Z configuration of polyhydroxy stilbenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2021-09-14 US disclosed
US-10723834-B1 Low melting and low viscosity thermoset matrix resins from the Z configuration of polyhydroxy stilbenes THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2020-07-28 US disclosed