SCHEMBL8042954

SCHEMBL8042954

Cc1[nH]c2ccccc2c1C1(c2ccc(N(C)C)cc2)OC(=O)c2ccc(N(C)C)cc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
TDP1 Q9NUW8 3/20 0.52
CYP3A4 P08684 2/20 0.52
HSD17B10 Q99714 2/20 0.52
HPGD P15428 1/20 0.52
HIF1A Q16665 1/20 0.52
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 4/20 0.38
MAPT P10636 4/20 0.38
KDM4E B2RXH2 2/20 0.38
GAA P10253 1/20 0.38
ALOX12 P18054 1/20 0.38
NPSR1 Q6W5P4 1/20 0.37
VDR P11473 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
POLB P06746 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
TP53 P04637 3/20 0.35
CFTR P13569 1/20 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
SCHEMBL10350354 0.92 ALDH1A1 (0.65) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL337223 0.91 ALDH1A1 (0.51) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL29383061 0.91 ALDH1A1 (0.51) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL9679707 0.87 ALDH1A1 (0.42) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL5147481 0.82 MAPT (0.47) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL11244641 0.81 ALDH1A1 (0.45) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL30387132 0.81 HPGD (0.43) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL1098701 0.81 HPGD (0.43) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL6265446 0.80 MAPT (0.43) ALDH1A1TDP1CYP3A4HSD17B10HPGD
SCHEMBL28348436 0.79 CFTR (0.57) ALDH1A1TDP1CYP3A4HSD17B10MEN1

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
US-6071851-A ADDING NON-CROSSLINKING TYPE ACRYLIC ALKALI THICKENING AGENT TO THE COATING SOLUTION OF THE INTERMEDIATE LAYER; HIGH WHITENESS, HIGH PRINTABILITY MITSUBHISHI PAPER MILLS LIMITED (JP) 2000-06-06 US disclosed