SCHEMBL30007722

SCHEMBL30007722

CCO/N=C(/C(=O)OC)c1ccccc1CBr

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.47
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
TSHR P16473 2/20 0.36
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.33
RAB9A P51151 1/20 0.33
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL8766703 0.88 HIF1A (0.46) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL7215593 0.88 HIF1A (0.46) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL7215595 0.88 HIF1A (0.46) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL30007831 0.87 HIF1A (0.60) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL3621281 0.87 HIF1A (0.60) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL29391748 0.87 HIF1A (0.60) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL3621278 0.87 HIF1A (0.60) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL6703043 0.87 HIF1A (0.60) HIF1AALDH1A1LMNATSHRHPGD
SCHEMBL7457535 0.86 TSHR (0.38) HIF1AALDH1A1LMNATSHRHTT
SCHEMBL8347840 0.82 HIF1A (0.45) HIF1AALDH1A1LMNATSHRHPGD

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-115201387-A Method for analyzing content of (E) -2- (2-bromomethylphenyl) -2-methoxyimino methyl acetate 京博农化科技有限公司 2022-10-18 CN disclosed