SCHEMBL30007831

SCHEMBL30007831

CO/N=C(\C(=O)OC)c1ccccc1CBr

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 8/20 0.60
LMNA P02545 2/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.34
CTSD P07339 1/20 0.34
POLB P06746 1/20 0.34

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
SCHEMBL6703043 1.00 HIF1A (0.60) HIF1ALMNAALDH1A1HPGDHSD17B10
SCHEMBL29391748 1.00 HIF1A (0.60) HIF1ALMNAALDH1A1HPGDHSD17B10
SCHEMBL3621281 1.00 HIF1A (0.60) HIF1ALMNAALDH1A1HPGDHSD17B10
SCHEMBL3621278 1.00 HIF1A (0.60) HIF1ALMNAALDH1A1HPGDHSD17B10
SCHEMBL27449802 0.88 HIF1A (0.57) HIF1ALMNAALDH1A1HPGDTSHR
SCHEMBL27407703 0.88 HIF1A (0.57) HIF1ALMNAALDH1A1HPGDTSHR
SCHEMBL7627809 0.88 HIF1A (0.62) HIF1ALMNAALDH1A1HPGDTSHR
SCHEMBL26144809 0.88 HIF1A (0.62) HIF1ALMNAALDH1A1HPGDTSHR
SCHEMBL30007722 0.87 HIF1A (0.47) HIF1ALMNAALDH1A1HPGDTSHR
SCHEMBL7773929 0.87 HIF1A (0.47) HIF1ALMNAALDH1A1HSD17B10TSHR

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