SCHEMBL30469478

SCHEMBL30469478

Cc1cccc(C#Cc2cccc(C)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 5/20 0.69
ACHE P22303 3/20 0.58
FFAR1 O14842 4/20 0.53
CA12 O43570 1/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
CA9 Q16790 1/20 0.50
FFAR4 Q5NUL3 1/20 0.47
ALDH1A1 P00352 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
APP P05067 1/20 0.43

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
SCHEMBL30469481 1.00 GRM5 (0.69) GRM5ACHEFFAR1CA12CA1
SCHEMBL4562089 1.00 GRM5 (0.69) GRM5ACHEFFAR1CA12CA1
SCHEMBL4946180 0.93 GRM5 (0.62) GRM5ACHEFFAR1CA12CA1
SCHEMBL7132620 0.90 GRM5 (0.59) GRM5ACHEFFAR1CA12CA1
SCHEMBL23704113 0.87 ACHE (0.57) GRM5ACHEFFAR1CA12CA1
SCHEMBL29794004 0.87 KCNH2 (0.59) GRM5ACHEFFAR1CA12CA1
SCHEMBL10035460 0.87 ALDH1A1 (0.64) GRM5ACHEFFAR1CA12CA1
SCHEMBL28841296 0.87 KCNH2 (0.59) GRM5ACHEFFAR1CA12CA1
SCHEMBL25128133 0.87 GRM5 (0.56) GRM5ACHEFFAR1CA12CA1
SCHEMBL7670848 0.85 GRM5 (0.55) GRM5ACHEFFAR1CA12CA1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120059050-A Preparation method and application of amphiphilic phosphine-containing porous organic copolymer supported palladium metal catalyst 青岛科技大学 2025-05-30 CN disclosed
CN-119346167-A Catalytic system and method for synthesizing diaryl acetylene from calcium carbide and iodo aromatic hydrocarbon 石河子大学 2025-01-24 CN disclosed
CN-117945820-A Method for synthesizing alpha, beta-unsaturated aldehyde compound by copper catalysis 江苏海洋大学 2024-04-30 CN disclosed
CN-113797978-B Preparation method and application of poly (triarylphosphine oxide) -supported palladium/copper bimetallic catalyst 青岛科技大学 2023-11-07 CN disclosed
CN-116283962-A Method for synthesizing imidazo [5,1-a ] isoquinoline derivatives through C-H activation/cyclization reaction 桂林理工大学 2023-06-23 CN disclosed