SCHEMBL29690128

SCHEMBL29690128

C[C@H]1CCCN1c1ccc(C(=O)O)cc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.46
GFER P55789 1/20 0.46
KDM4E B2RXH2 3/20 0.46
POLB P06746 2/20 0.46
HSD17B10 Q99714 2/20 0.46
NR4A1 P22736 1/20 0.46
HPGD P15428 5/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 4/20 0.44
ALDH1A1 P00352 3/20 0.43
TSHR P16473 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
RAB9A P51151 4/20 0.42
NPC1 O15118 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
GPR174 Q9BXC1 2/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL28943785 1.00 GAA (0.46) GAAGFERKDM4EPOLBHSD17B10
SCHEMBL28771928 1.00 GAA (0.46) GAAGFERKDM4EPOLBHSD17B10
SCHEMBL13133518 0.89 MAPT (0.50) GAAGFERHPGDSMN1; SMN2MAPT
SCHEMBL2814598 0.89 MAPT (0.50) GAAGFERHPGDSMN1; SMN2MAPT
SCHEMBL28771544 0.85 ALOX15 (0.53) GAAGFERKDM4EHSD17B10HPGD
SCHEMBL28771543 0.85 ALOX15 (0.53) GAAGFERKDM4EHSD17B10HPGD
SCHEMBL13133519 0.84 GAA (0.51) GAAGFERKDM4EHPGDSMN1; SMN2
SCHEMBL29690030 0.84 GAA (0.51) GAAGFERKDM4EHPGDSMN1; SMN2
SCHEMBL28771639 0.84 GAA (0.51) GAAGFERKDM4EHPGDSMN1; SMN2
SCHEMBL1479064 0.83 GFER (0.46) GAAGFERKDM4EPOLBHSD17B10

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-114891003-B Novel dihydropyrimidine compound, intermediate or salt, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2023-10-13 CN disclosed
CN-114656472-B Pyrazolopyrimidine compound, isomer or salt, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2023-07-04 CN disclosed
CN-114891003-A Novel dihydropyrimidine compounds, intermediates or salts, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2022-08-12 CN disclosed
CN-114671875-A Novel dihydropyrimidine compound, isomer or salt, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2022-06-28 CN disclosed
CN-114656472-A Pyrazolopyrimidine compound, isomer or salt, and preparation method and application thereof 成都施贝康生物医药科技有限公司 2022-06-24 CN disclosed