SCHEMBL30499372

SCHEMBL30499372

O=C1OC(=O)c2c1cccc2-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HDAC4 P56524 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
TYMS P04818 1/20 0.42
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 2/20 0.41
MEN1 O00255 1/20 0.41
APAF1 O14727 1/20 0.41
NPC1 O15118 1/20 0.41
THRB P10828 1/20 0.41
XBP1 P17861 1/20 0.41
PTBP1 P26599 1/20 0.41
RAB9A P51151 1/20 0.41
GALK1 P51570 1/20 0.41
BLM P54132 1/20 0.41
SMAD3 P84022 1/20 0.41

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
SCHEMBL29067257 1.00 ALOX15 (0.50) ALOX15TDP1HDAC4HDAC2HDAC8
SCHEMBL542116 0.96 TDP1 (0.54) ALOX15TDP1HDAC4HDAC2HDAC8
SCHEMBL308375 0.92 TDP1 (0.52) ALOX15TDP1HDAC4HDAC2HDAC8
SCHEMBL31416073 0.92 TDP1 (0.52) ALOX15TDP1HDAC4HDAC2HDAC8
SCHEMBL11714264 0.83 TDP1 (0.59) ALOX15TDP1HDAC4HDAC2HDAC8
SCHEMBL6300640 0.82 TSHR (0.43) ALOX15TDP1TYMSLMNAMAPT
SCHEMBL5177942 0.82 TTR (0.47) HDAC4HDAC2HDAC8HDAC6TYMS
SCHEMBL28148705 0.82 ALOX15 (0.46) ALOX15TDP1HDAC4HDAC2HDAC8
SCHEMBL2087097 0.80 TDP1 (0.60) ALOX15TDP1TYMSLMNAMAPT
SCHEMBL31548711 0.80 TDP1 (0.60) ALOX15TDP1TYMSLMNAMAPT

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
CN-116655912-A Solvent-soluble polyimide resin 合肥汉之和新材料科技有限公司 2023-08-29 CN claimed
CN-116655912-A Solvent-soluble polyimide resin 合肥汉之和新材料科技有限公司 2023-08-29 CN disclosed