SCHEMBL8286395

SCHEMBL8286395

Cc1cc(OCC(F)F)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.44
POLB P06746 1/20 0.37
GSK3B P49841 3/20 0.37
MAPK1 P28482 3/20 0.36
GAA P10253 3/20 0.36
HPGD P15428 2/20 0.36
KDM4E B2RXH2 3/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ATM Q13315 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CSF1R P07333 1/20 0.35
UGCG Q16739 1/20 0.35
HTT P42858 3/20 0.34
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
SMN1; SMN2 Q16637 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

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
SCHEMBL8286383 0.86 PDE11A (0.51) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8286366 0.85 PDE11A (0.43) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8286379 0.85 PDE11A (0.43) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8287832 0.84 PDE11A (0.47) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8286377 0.84 PDE11A (0.45) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8286416 0.83 PDE11A (0.42) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8287893 0.83 PDE11A (0.44) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8287417 0.83 HTT (0.47) PDE11AMAPK1HPGDKDM4ENPSR1
SCHEMBL8286076 0.82 PDE11A (0.39) PDE11APOLBGSK3BMAPK1GAA
SCHEMBL8286402 0.82 ALDH1A1 (0.43) PDE11APOLBMAPK1GAAHPGD

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