SCHEMBL29930599

SCHEMBL29930599

CC(=NOC(=O)c1ccccc1)c1ccc2c(c1)c1cc(C(=O)c3ccccc3C)ccc1n2C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
HTT P42858 1/20 0.50
MAPT P10636 6/20 0.46
PKM P14618 1/20 0.46
CDK5 Q00535 1/20 0.46
CDK5R1 Q15078 1/20 0.46
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 2/20 0.43
NPY1R P25929 1/20 0.42
NPY2R P49146 1/20 0.42
CASP3 P42574 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.39

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
SCHEMBL10098925 0.90 ALDH1A1 (0.53) ALDH1A1HTTMAPTRAB9ANPC1
SCHEMBL9970780 0.90 ALDH1A1 (0.53) ALDH1A1HTTMAPTRAB9ANPC1
SCHEMBL29824485 0.89 MAPT (0.47) ALDH1A1HTTMAPTPKMCDK5
SCHEMBL3209043 0.89 MAPT (0.47) ALDH1A1HTTMAPTPKMCDK5
SCHEMBL12629353 0.89 MAPT (0.47) ALDH1A1HTTMAPTPKMCDK5
SCHEMBL9962628 0.81 KDM4E (0.50) ALDH1A1MAPTPKMCDK5CDK5R1
SCHEMBL12609525 0.81 ALDH1A1 (0.46) ALDH1A1HTTMAPTRAB9ANPC1
SCHEMBL626556 0.80 ALDH1A1 (0.63) ALDH1A1HTTMAPTNPC1KMT2A
SCHEMBL31145039 0.80 ALDH1A1 (0.63) ALDH1A1HTTMAPTNPC1KMT2A
SCHEMBL23346983 0.79 HPGD (0.51) ALDH1A1HTTMAPTNPC1KMT2A

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-115073661-A Resin composition and display device using same 三星显示有限公司 2022-09-20 CN disclosed