SCHEMBL29028189

SCHEMBL29028189

C=CC(=O)Oc1ccc(-c2cccc3c2Cc2ccccc2-3)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
HTR7 P34969 1/20 0.39
HTR2B P41595 1/20 0.39
THRB P10828 3/20 0.38
PDE6D O43924 1/20 0.37
PNMT P11086 1/20 0.37
TYMS P04818 1/20 0.34
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MEN1 O00255 1/20 0.33
PKM P14618 1/20 0.33
KMT2A Q03164 1/20 0.33
SRD5A2 P31213 1/20 0.33
APP P05067 1/20 0.33
SNCA P37840 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33

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
SCHEMBL12701487 0.87 NPC1 (0.40) NPC1RAB9AHTR7HTR2BPNMT
SCHEMBL12701197 0.85 TYMS (0.39) NPC1RAB9AHTR7HTR2BTHRB
SCHEMBL587231 0.84 THRB (0.56) NPC1RAB9AHTR7HTR2BTHRB
SCHEMBL30292645 0.84 THRB (0.56) NPC1RAB9AHTR7HTR2BTHRB
SCHEMBL27862496 0.84 NPC1 (0.43) NPC1RAB9AHTR7HTR2BPNMT
SCHEMBL31628069 0.83 RAB9A (0.43) NPC1RAB9AHTR7HTR2BTHRB
SCHEMBL1331344 0.82 RAB9A (0.44) NPC1RAB9AHTR7HTR2BTHRB
SCHEMBL28108164 0.82 ELANE (0.48) NPC1RAB9AHTR7HTR2BPNMT
Acrylic Acid SCHEMBL1315279 0.81 NPC1 (0.47) NPC1RAB9AHTR7HTR2BPNMT
Fluorene SCHEMBL1315275 0.81 SRD5A2 (0.46) HTR7HTR2BTHRBPDE6DMAPT

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-110392864-B Negative photosensitive resin composition, cured film, element and organic EL display having cured film, and method for producing same 东丽株式会社 2023-05-23 CN disclosed