SCHEMBL28148705

SCHEMBL28148705

O=C1OC(=O)c2c1ccc(-c1ccccc1)c2-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTT P42858 3/20 0.44
LMNA P02545 2/20 0.44
MAPT P10636 2/20 0.44
CTRC Q99895 2/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CHEK1 O14757 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
MAOB P27338 2/20 0.35
RAB9A P51151 2/20 0.35
KDM4E B2RXH2 2/20 0.35
PTGS2 P35354 1/20 0.35
ALDH1A1 P00352 1/20 0.35
TYMS P04818 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
SCHEMBL542116 0.85 TDP1 (0.54) ALOX15TDP1HTTLMNAMAPT
SCHEMBL30499372 0.82 ALOX15 (0.50) ALOX15TDP1HTTLMNAMAPT
SCHEMBL29067257 0.82 ALOX15 (0.50) ALOX15TDP1HTTLMNAMAPT
SCHEMBL11714264 0.80 TDP1 (0.59) ALOX15TDP1HTTLMNAMAPT
SCHEMBL27922461 0.80 TYMS (0.50) ALOX15TDP1HTTLMNAMAPT
SCHEMBL608536 0.79 ALDH1A1 (0.50) HTTLMNAMAPTCTRCHDAC4
SCHEMBL17819102 0.79 ALOX15 (0.41) ALOX15TDP1HTTLMNAMAPT
SCHEMBL28496968 0.79 ALOX5 (0.42) HTTLMNAMAPTCTRCHDAC4
SCHEMBL4802119 0.77 HNF4A (0.49) ALOX15LMNAMAPTHDAC4HDAC2
SCHEMBL2778432 0.77 MAPT (0.57) ALOX15TDP1HTTLMNAMAPT

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
CN-106831745-A A kind of electroluminescent organic material and organic photoelectric device 上海天马有机发光显示技术有限公司 2017-06-13 CN disclosed