SCHEMBL29237378

SCHEMBL29237378

CCOC(=O)C(CCc1ccccc1)Nc1ccc(OC)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.52
RAB9A P51151 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
MAPT P10636 2/20 0.49
FPR2 P25090 1/20 0.48
KMT2A Q03164 4/20 0.48
GLA P06280 1/20 0.48
NPC1 O15118 2/20 0.48
GAA P10253 2/20 0.47
RECQL P46063 1/20 0.47
TAAR1 Q96RJ0 1/20 0.47
MMP3 P08254 2/20 0.47
MMP1 P03956 2/20 0.46
MMP2 P08253 2/20 0.46
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
POLB P06746 2/20 0.46
MEN1 O00255 2/20 0.46

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
SCHEMBL29283528 0.90 KMT2A (0.51) ALDH1A1SMN1; SMN2MAPTKMT2AGLA
SCHEMBL29237310 0.88 FPR2 (0.57) ALDH1A1RAB9ASMN1; SMN2MAPTFPR2
SCHEMBL28507024 0.88 SMN1; SMN2 (0.51) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL28774738 0.83 TAS1R3 (0.51) ALDH1A1MAPTKMT2AGLANPC1
SCHEMBL5339626 0.82 CA12 (0.52) ALDH1A1RAB9ASMN1; SMN2MAPTFPR2
SCHEMBL28352594 0.81 ALDH1A1 (0.59) ALDH1A1RAB9AKMT2ANPC1GAA
SCHEMBL28416132 0.81 MMP9 (0.47) KMT2AGAAMMP3MMP1MMP2
SCHEMBL5954359 0.80 ALDH1A1 (0.59) ALDH1A1RAB9ASMN1; SMN2MAPTNPC1
SCHEMBL813251 0.80 CA12 (0.50) ALDH1A1RAB9ASMN1; SMN2MAPTFPR2
SCHEMBL4346711 0.79 RAB9A (0.43) ALDH1A1RAB9ASMN1; SMN2MAPTFPR2

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-118239850-A Synthesis and application of alpha-alkyl glycine derivative 西北师范大学 2024-06-25 CN disclosed