SCHEMBL28800533

SCHEMBL28800533

Cc1cc(C)c2sc3ccccc3c(=O)c2c1C

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.57
ALDH1A1 P00352 4/20 0.57
POLB P06746 2/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
HCRTR1 O43613 1/20 0.57
LMNA P02545 1/20 0.57
MEN1 O00255 1/20 0.56
GAA P10253 1/20 0.56
KMT2A Q03164 1/20 0.56
APP P05067 4/20 0.47
MAOA P21397 2/20 0.47
CHRM2 P08172 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
DRD1 P21728 1/20 0.47
TBXA2R P21731 1/20 0.47
SLC6A2 P23975 1/20 0.47
APEX1 P27695 1/20 0.47

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
SCHEMBL30913888 1.00 MAPT (0.57) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL29178545 0.86 ALDH1A1 (0.47) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL30161909 0.86 MAPT (0.61) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL8086616 0.86 MAPT (0.52) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL29089077 0.84 MAPT (0.50) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL10059336 0.83 MAPT (0.58) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL26194151 0.81 MAPT (0.53) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL28815388 0.80 ALDH1A1 (0.49) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL8086595 0.79 ALDH1A1 (0.63) MAPTALDH1A1POLBL3MBTL1HCRTR1
SCHEMBL26194399 0.79 MAPT (0.75) MAPTALDH1A1POLBL3MBTL1HCRTR1

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-118109081-A LED (light-emitting diode) curing ink-jet printing ink and preparation method thereof 深圳市墨库新材料集团股份有限公司 2024-05-31 CN disclosed
CN-114686025-A Photocurable liquid composition, cured product, and method for producing cured product 东京应化工业株式会社 2022-07-01 CN disclosed