SCHEMBL875237

SCHEMBL875237

NC(=O)c1c(C/C=N/OCCF)ccc2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
PARP10 Q53GL7 1/20 0.33
ABCG2 Q9UNQ0 3/20 0.32
MMP3 P08254 1/20 0.32
IDO1 P14902 1/20 0.31
LMNA P02545 3/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
MTNR1A P48039 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
MAPK8 P45983 1/20 0.31
PKM P14618 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL875239 1.00 MEN1 (0.33) MEN1KMT2APARP10ABCG2MMP3
SCHEMBL876121 0.83 ALDH1A1 (0.40) MEN1KMT2APARP10ABCG2MMP3
SCHEMBL876123 0.83 ALDH1A1 (0.40) MEN1KMT2APARP10ABCG2MMP3
SCHEMBL4575100 0.74 MEN1 (0.38) MEN1KMT2APARP10ABCG2KDM4E
SCHEMBL19325982 0.73 PARP10 (0.46) MEN1KMT2APARP10IDO1KDM4E
SCHEMBL4666055 0.73 MEN1 (0.38) MEN1KMT2APARP10ABCG2KDM4E
SCHEMBL15345389 0.73 KDM4E (0.44) MEN1KMT2APARP10KDM4EALDH1A1
SCHEMBL366864 0.72 MTNR1A (0.37) MEN1KMT2APARP10ABCG2KDM4E
SCHEMBL3936169 0.72 MEN1 (0.40) MEN1KMT2APARP10ABCG2KDM4E
SCHEMBL28000844 0.71 MTNR1A (0.42) MEN1KMT2APARP10KDM4EALDH1A1

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
EP-2619189-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS Zoetis LLC (US) 2013-07-31 EP claimed
WO-2012038851-A1 ISOXAZOLINE OXIMES AS ANTIPARASITIC AGENTS PFIZER INC. (US) 2012-03-29 WO claimed