SCHEMBL8405191

SCHEMBL8405191

COC(=O)C(=NOCC#N)c1ccccc1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.44
TSHR P16473 1/20 0.44
HIF1A Q16665 7/20 0.41
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HPGD P15428 3/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
CYP2C19 P33261 2/20 0.38
NPC1 O15118 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
KDM4E B2RXH2 3/20 0.37
HSD17B10 Q99714 1/20 0.37
GAA P10253 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
EGFR P00533 1/20 0.35
NOX4 Q9NPH5 1/20 0.35

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
SCHEMBL7217221 0.82 LMNA (0.47) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL7217224 0.82 LMNA (0.47) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL7119395 0.79 LMNA (0.55) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL6705432 0.79 LMNA (0.55) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL6705433 0.79 LMNA (0.55) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL7124258 0.75 LMNA (0.56) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL7127706 0.75 LMNA (0.56) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL7124266 0.75 LMNA (0.56) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL8080116 0.73 LMNA (0.44) LMNATSHRHIF1AALDH1A1SMN1; SMN2
SCHEMBL8406508 0.73 LMNA (0.44) LMNATSHRHIF1AALDH1A1SMN1; SMN2

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
US-5977123-A Oximether and acrylic acid derivatives and their use as fungicides BAYER AKTIENGESELLSCGAFT (DE) 1999-11-02 US disclosed