SCHEMBL29628813

SCHEMBL29628813

Cc1ccc(O)c(Cc2cc(Cc3cc(C)ccc3O)c(O)c(C3CCCCC3)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.54
NUDT1 P36639 1/20 0.43
BACE1 P56817 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.39
NPC1 O15118 3/20 0.35
GAA P10253 2/20 0.35
HTT P42858 2/20 0.35
PKM P14618 1/20 0.35
HSP90AA1 P07900 1/20 0.35
CYP2C19 P33261 2/20 0.34
KMT2A Q03164 2/20 0.34
CYP2C9 P11712 1/20 0.34
HIF1A Q16665 1/20 0.34
THRB P10828 2/20 0.34
SLC2A1 P11166 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
THRA P10827 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL29636453 1.00 AMY1A (0.54) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL2676397 1.00 AMY1A (0.54) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL29695928 0.87 BACE1 (0.46) AMY1ANUDT1BACE1HSP90AA1CYP2C19
SCHEMBL9445214 0.85 NUDT1 (0.43) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL1276251 0.84 AMY1A (0.42) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL2545354 0.84 AMY1A (0.50) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL2385696 0.84 NUDT1 (0.39) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL27221198 0.83 AMY1A (0.51) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL29908289 0.82 AMY1A (0.48) AMY1ANUDT1BACE1PTGDR2NPC1
SCHEMBL3199214 0.82 AMY1A (0.48) AMY1ANUDT1BACE1PTGDR2NPC1

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-111919173-B Positive photosensitive resin composition, cured film thereof, and solid-state imaging device provided with cured film 东丽株式会社 2024-04-02 CN disclosed
CN-108136804-B Compounds for use in color-changing compositions 比克公司 2022-06-24 CN disclosed