SCHEMBL8287366

SCHEMBL8287366

CC(C)CSc1cc(C(F)(F)F)c2c(=O)cc(Nc3ccccc3)n(-c3ccccc3)c2n1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.57
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 1/20 0.35
WEE1 P30291 1/20 0.34
GSK3B P49841 3/20 0.33
CNR1 P21554 2/20 0.33
CNR2 P34972 2/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
POLB P06746 1/20 0.33
GAA P10253 1/20 0.33
PIK3CD O00329 1/20 0.32
PIK3R2 O00459 1/20 0.32
PIK3CG P48736 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.31

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
SCHEMBL7042467 0.90 PDE11A (0.60) PDE11AMEN1KMT2AALDH1A1WEE1
SCHEMBL8285157 0.88 PDE11A (0.60) PDE11AMEN1KMT2AALDH1A1KDM4E
SCHEMBL8287191 0.87 PDE11A (0.59) PDE11AMEN1KMT2AALDH1A1WEE1
SCHEMBL5871955 0.86 PDE11A (0.56) PDE11AMEN1KMT2AALDH1A1KDM4E
SCHEMBL5871578 0.86 PDE11A (0.58) PDE11AMEN1KMT2AALDH1A1CNR1
SCHEMBL8286360 0.85 PDE11A (0.55) PDE11AMEN1KMT2AALDH1A1KDM4E
SCHEMBL8286363 0.84 PDE11A (0.56) PDE11AMEN1KMT2AALDH1A1MAPK1
SCHEMBL8287106 0.84 PDE11A (0.54) PDE11AALDH1A1KDM4EMAPK1CNR1
SCHEMBL8287836 0.84 PDE11A (0.56) PDE11AALDH1A1KDM4ELMNAMAPT
SCHEMBL8287819 0.83 PDE11A (0.53) PDE11AMEN1KMT2AALDH1A1MAPK1

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