SCHEMBL29080888

SCHEMBL29080888

CO/N=C(\C)C(=O)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.44
MAPT P10636 5/20 0.41
ALDH1A1 P00352 3/20 0.41
TDP1 Q9NUW8 2/20 0.40
GAA P10253 2/20 0.40
USP2 O75604 1/20 0.40
KDM4E B2RXH2 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HPGD P15428 2/20 0.39
ATM Q13315 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
HSD17B10 Q99714 2/20 0.38
ALOX15 P16050 1/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PKM P14618 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 1/20 0.37
CYP1A2 P05177 1/20 0.37
NPC1 O15118 1/20 0.37

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
SCHEMBL14667478 1.00 ELANE (0.44) ELANEMAPTALDH1A1TDP1GAA
SCHEMBL28613979 1.00 ELANE (0.44) ELANEMAPTALDH1A1TDP1GAA
SCHEMBL27494062 0.84 LMNA (0.55) ALDH1A1TDP1GAAUSP2CYP1A2
SCHEMBL10952497 0.81 ELANE (0.46) ELANEMAPTALDH1A1TDP1GAA
SCHEMBL10952501 0.81 ELANE (0.46) ELANEMAPTALDH1A1TDP1GAA
SCHEMBL28899223 0.81 MAPT (0.41) ELANEMAPTALDH1A1TDP1GAA
SCHEMBL27447670 0.79 ELANE (0.45) ELANEMAPTALDH1A1TDP1USP2
SCHEMBL8623908 0.78 HIF1A (0.46) KDM4EL3MBTL1SMN1; SMN2
Diphenyl Ethanedioat SCHEMBL27942895 0.78 ELANE (0.53) ELANEMAPTALDH1A1TDP1GAA
SCHEMBL28409661 0.77 ELANE (0.37) ELANEMAPTTDP1GAAUSP2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117185954-A Preparation method of (E) -2-methyl-alpha-methoxyiminophenylacetic acid methyl ester and intermediate thereof 江西天宇化工有限公司 2023-12-08 CN disclosed
CN-112851546-B Preparation method of (E) -2-methyl-alpha-methoxyiminophenylacetic acid methyl ester and intermediate thereof 江西天宇化工有限公司 2023-10-03 CN disclosed