SCHEMBL8286401

SCHEMBL8286401

Cc1cc(C(=O)N(C(C)C)C(C)C)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.42
POLB P06746 2/20 0.35
GSK3B P49841 2/20 0.35
HPGD P15428 4/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 3/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 2/20 0.34
MCOLN3 Q8TDD5 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CCND2 P30279 1/20 0.34
CCND3 P30281 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 3/20 0.33
GFER P55789 1/20 0.33
MAPK1 P28482 1/20 0.33
CSF1R P07333 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL8285223 0.87 PDE11A (0.44) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL5872175 0.87 PDE11A (0.47) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL8286384 0.86 PDE11A (0.42) PDE11APOLBHPGDALDH1A1MAPT
SCHEMBL5871541 0.86 PDE11A (0.46) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL5872166 0.85 PDE11A (0.42) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL8287397 0.85 PDE11A (0.46) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL8287393 0.85 PDE11A (0.46) PDE11APOLBHPGDALDH1A1MAPT
SCHEMBL8285181 0.84 PDE11A (0.42) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL8285169 0.84 PDE11A (0.45) PDE11APOLBGSK3BHPGDALDH1A1
SCHEMBL8287518 0.83 PDE11A (0.44) PDE11APOLBGSK3BHPGDALDH1A1

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