SCHEMBL10692219

SCHEMBL10692219

O=C1OC(=O)c2c1cccc2C(=O)c1ccccc1C(=O)c1cccc2c1C(=O)OC2=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
TYMS P04818 2/20 0.42
ALDH1A1 P00352 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
LMNA P02545 1/20 0.42
MAPT P10636 1/20 0.42
KEAP1 Q14145 2/20 0.41
NFE2L2 Q16236 1/20 0.41
HNF4A P41235 1/20 0.39
MYC P01106 1/20 0.38
CDC25B P30305 1/20 0.38
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
NPC1 O15118 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL1000050 0.96 ALOX15 (0.46) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL29882743 0.96 ALOX15 (0.46) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL11350890 0.93 TYMS (0.49) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL11731806 0.92 ALOX15 (0.41) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL1271125 0.87 ALDH1A1 (0.49) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL8837160 0.84 TDP1 (0.42) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL617136 0.82 ALDH1A1 (0.56) ALOX15TDP1TYMSALDH1A1L3MBTL1
SCHEMBL3544809 0.81 KEAP1 (0.58) ALOX15TDP1TYMSALDH1A1MAPT
SCHEMBL18301594 0.81 PDK2 (0.44) ALOX15TDP1TYMSALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL28875558 0.81 ALDH1A1 (0.55) ALOX15TDP1TYMSALDH1A1L3MBTL1

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
EP-0253765-A1 Diamino-9,10-dihydroanthracenes and polyamide-acid (esters) and polyimides thereof CIBA-GEIGY AG (CH) 1988-01-20 EP disclosed