SCHEMBL22493944

SCHEMBL22493944

Cc1cc(C2(c3cc(C)c(OCCOCC4CO4)c(C)c3)CCc3ccccc32)cc(C)c1OCCOCC1CO1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
GLA P06280 1/20 0.36
TDP1 Q9NUW8 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
TSHR P16473 2/20 0.32
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
HIF1A Q16665 1/20 0.32
HTR2A P28223 2/20 0.32
HTR7 P34969 2/20 0.32
HTR1A P08908 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR6 P50406 1/20 0.32
KDM4E B2RXH2 1/20 0.32
POLB P06746 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 1/20 0.31
SIGMAR1 Q99720 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL21829164 0.87 ALDH1A1 (0.40) ALDH1A1GLATDP1SMN1; SMN2TSHR
SCHEMBL22493967 0.85 PRMT5 (0.35) ALDH1A1GLATSHRCYP3A4POLB
SCHEMBL21829152 0.83 TDP1 (0.40) ALDH1A1GLATDP1SMN1; SMN2TSHR
SCHEMBL22493968 0.83 ALDH1A1 (0.33) ALDH1A1GLATDP1SMN1; SMN2TSHR
SCHEMBL17061462 0.80 ESR1 (0.40) ALDH1A1GLATDP1SMN1; SMN2TSHR
SCHEMBL17985079 0.79 ESR1 (0.39) ALDH1A1GLATDP1SMN1; SMN2TSHR
SCHEMBL22493958 0.79 MEN1 (0.37) ALDH1A1GLATDP1SMN1; SMN2TP53
SCHEMBL22493954 0.78 TDP1 (0.40) ALDH1A1TDP1SMN1; SMN2TSHRTP53
SCHEMBL28406981 0.77 PRMT5 (0.35) ALDH1A1GLACYP3A4
SCHEMBL21829166 0.76 ALDH1A1 (0.33) ALDH1A1GLATDP1SMN1; SMN2TSHR

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
US-20200319549-A1 PHOTOSENSITIVE RESIN COMPOSITION, CURED FILM, ELEMENT HAVING CURED FILM, ORGANIC EL DISPLAY, AND METHOD FOR MANUFACTURING ORGANIC EL DISPLAY TORAY INDUSTRIES, INC. (JP) 2020-10-08 US disclosed
CN-111164512-A Photosensitive resin composition, cured film, element provided with cured film, organic EL display, and method for manufacturing organic EL display 东丽株式会社 2020-05-15 CN disclosed