SCHEMBL19975664

SCHEMBL19975664

CO/C=C(/C(=O)OC)c1ccccc1Oc1cc(Oc2ccccc2Cl)ncn1

nearest known ligand 0.72

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
KDR P35968 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
ATM Q13315 1/20 0.36
MAPK8 P45983 2/20 0.36
HPGD P15428 1/20 0.36
RAB9A P51151 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPK10 P53779 1/20 0.35
MAP4K4 O95819 1/20 0.35
HTT P42858 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
SCHEMBL16561719 0.93 MEN1 (0.41) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL1223741 0.91 SMN1; SMN2 (0.42) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29657093 0.91 SMN1; SMN2 (0.42) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2996165 0.91 SMN1; SMN2 (0.42) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL31493947 0.91 SMN1; SMN2 (0.42) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL29391047 0.91 SMN1; SMN2 (0.42) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL709624 0.91 SMN1; SMN2 (0.42) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9121807 0.89 HTT (0.44) SMN1; SMN2ALDH1A1MEN1KMT2AKDR
SCHEMBL9121820 0.89 HTT (0.44) SMN1; SMN2ALDH1A1MEN1KMT2AKDR
SCHEMBL203422 0.88 HTR2C (0.38) NPSR1SMN1; SMN2ALDH1A1MEN1KMT2A

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
US-9920015-B2 Methods for preparing azoxystrobin and intermediate thereof NUTRICHEM COMPANY LIMITED (CN) 2018-03-20 US disclosed
US-9920015-B2 Methods for preparing azoxystrobin and intermediate thereof NUTRICHEM COMPANY LIMITED (CN) 2018-03-20 US disclosed