SCHEMBL29138367

SCHEMBL29138367

CCCCc1ccc(O)c(CCc2ccccc2)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.57
ALOX15 P16050 1/20 0.57
KAT8 Q9H7Z6 3/20 0.49
EP300 Q09472 1/20 0.49
KAT5 Q92993 1/20 0.49
HPGD P15428 2/20 0.49
ALDH1A1 P00352 1/20 0.49
HSD17B10 Q99714 1/20 0.49
NPC1 O15118 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
BACE1 P56817 1/20 0.46
DRD2 P14416 1/20 0.46
OPRM1 P35372 1/20 0.46
DRD3 P35462 1/20 0.46
OPRD1 P41143 1/20 0.46
OPRK1 P41145 1/20 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
SCHEMBL8409251 0.94 IGF1R (0.58) IGF1RALOX15KAT8EP300KAT5
SCHEMBL9487127 0.88 ALOX15 (0.60) IGF1RALOX15HPGDHSD17B10BACE1
SCHEMBL1024663 0.86 HPGD (0.57) IGF1RALOX15KAT8HPGDALDH1A1
SCHEMBL5699002 0.85 TRPA1 (0.52) IGF1RALOX15HPGDALDH1A1HSD17B10
SCHEMBL1021131 0.84 ALOX5 (0.60) IGF1RALOX15KAT8HPGDALDH1A1
SCHEMBL28055345 0.84 HPGD (0.55) IGF1RALOX15KAT8HPGDALDH1A1
Phosphine SCHEMBL28136514 0.84 HPGD (0.55) IGF1RALOX15KAT8HPGDALDH1A1
SCHEMBL1022601 0.83 KAT8 (0.57) IGF1RALOX15KAT8HPGDALDH1A1
SCHEMBL10778091 0.83 KAT8 (0.57) IGF1RALOX15KAT8HPGDALDH1A1
SCHEMBL1024270 0.83 KAT8 (0.57) IGF1RALOX15KAT8HPGDALDH1A1

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-114957152-B Synthesis method of benzoxazole compound 湖南第一师范学院 2023-11-17 CN disclosed