SCHEMBL8286136

SCHEMBL8286136

Cc1ccc2c(=O)c(COC3CCCC3)c(Nc3ccccc3)n(-c3ccccc3)c2n1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 7/20 0.46
MAPK9 P45984 6/20 0.46
MAPK10 P53779 6/20 0.46
MAT2A P31153 1/20 0.42
ALDH1A1 P00352 3/20 0.35
POLB P06746 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
KCNH2 Q12809 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
HPGD P15428 1/20 0.34
ALOX12 P18054 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
MAPK1 P28482 2/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 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
SCHEMBL8286133 0.85 MAT2A (0.50) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8286126 0.85 MAPK8 (0.46) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8286135 0.83 MAT2A (0.46) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8287392 0.81 MAPK8 (0.47) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8286138 0.80 MAT2A (0.43) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8285234 0.79 MAT2A (0.47) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8285229 0.76 MAPK8 (0.50) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8287156 0.76 MAT2A (0.50) MAPK8MAPK9MAPK10MAT2AALDH1A1
SCHEMBL8287183 0.74 MAT2A (0.48) MAPK8MAPK9MAPK10MAT2APOLB
SCHEMBL5871674 0.73 SMN1; SMN2 (0.50) MAPK8MAPK9MAPK10MAT2AALDH1A1

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
WO-2005091857-A2 1,6-NAPHTHYRIDINE AND 1,8-NAPHTHYRIDINE DERIVATIVES AND THEIR USE TO TREAT DIABETES AND RELATED DISORDERS BAYER PHARMACEUTICALS CORPORATION (US) 2005-10-06 WO disclosed
WO-2003027112-A1 1, 8-NAPHTHYRIDINE DERIVATIVES AS ANTIDIABETICS BAYER PHARMACEUTICALS CORPORATION (US) 2003-04-03 WO disclosed