SCHEMBL27744865

SCHEMBL27744865

NCc1cccc(-c2noc(NC(=O)CCc3ccccc3)c2-c2ccncc2)c1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.71
LMNA P02545 1/20 0.47
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
CFD P00746 2/20 0.41
TTK P33981 1/20 0.41
KDM6B O15054 1/20 0.40
KDM4D Q6B0I6 1/20 0.40
KDM4C Q9H3R0 1/20 0.40
EGLN3 Q9H6Z9 1/20 0.40
NPY5R Q15761 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL27744893 0.95 MAPK14 (0.63) MAPK14LMNACFD
SCHEMBL27765823 0.92 MAPK14 (0.80) MAPK14LMNAGAAMAPTKDM6B
SCHEMBL27765847 0.92 MAPK14 (0.59) MAPK14LMNACFD
SCHEMBL27765846 0.90 MAPK14 (0.70) MAPK14CFDALDH1A1HPGDHSD17B10
SCHEMBL27834750 0.89 MAPK14 (0.59) MAPK14LMNACFDTTK
SCHEMBL4334980 0.89 MAPK14 (0.88) MAPK14LMNAMAPTKDM6BKDM4D
SCHEMBL4329415 0.88 MAPK14 (0.71) MAPK14LMNAMAPTKDM4EALDH1A1
SCHEMBL4333469 0.88 MAPK14 (0.86) MAPK14LMNAKDM6BKDM4DKDM4C
SCHEMBL27765813 0.86 MAPK14 (0.73) MAPK14LMNA
SCHEMBL27744896 0.86 MAPK14 (0.68) MAPK14LMNAKDM6BKDM4DKDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101472921-A Pyridylisoxazole derivative ASKA PHARM CO LTD (JP) 2009-07-01 CN claimed
CN-101472921-B Pyridylisoxazole derivative ASKA PHARM CO LTD 2012-10-10 CN disclosed
CN-101472921-A Pyridylisoxazole derivative ASKA PHARM CO LTD (JP) 2009-07-01 CN disclosed