SCHEMBL8285146

SCHEMBL8285146

CC(C)CS(=O)(=O)c1cc(C(F)(F)F)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.56
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
WEE1 P30291 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
GSK3B P49841 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
DRD2 P14416 1/20 0.32
HTR6 P50406 1/20 0.32
CDK4 P11802 3/20 0.32
CCND1 P24385 3/20 0.32
CCND2 P30279 3/20 0.32
CCND3 P30281 3/20 0.32
PIK3CD O00329 1/20 0.32
PIK3R2 O00459 1/20 0.32

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
SCHEMBL8360285 0.88 PDE11A (0.59) PDE11AKDM4EMAPK1WEE1MEN1
SCHEMBL5871948 0.86 PDE11A (0.56) PDE11AWEE1MEN1KMT2ACNR1
SCHEMBL8287231 0.84 PDE11A (0.64) PDE11AWEE1MEN1KMT2ACNR1
SCHEMBL8287366 0.81 PDE11A (0.57) PDE11AKDM4EMAPK1WEE1MEN1
SCHEMBL8286352 0.79 PDE11A (0.60) PDE11AWEE1MEN1KMT2ACNR1
SCHEMBL8285157 0.79 PDE11A (0.60) PDE11AKDM4EMAPK1WEE1MEN1
SCHEMBL5872148 0.79 PDE11A (0.60) PDE11AWEE1MEN1KMT2ACNR1
SCHEMBL8287500 0.79 PDE11A (0.57) PDE11AWEE1MEN1KMT2ACNR1
SCHEMBL5872038 0.78 PDE11A (0.66) PDE11AMAPK1WEE1MEN1KMT2A
SCHEMBL6879695 0.78 PDE11A (0.66) PDE11AMAPK1WEE1MEN1KMT2A

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