SCHEMBL8285267

SCHEMBL8285267

O=c1cc(Nc2ccccc2)n(-c2ccccc2)c2nc(CNc3ccccc3)cc(C(F)(F)F)c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.62
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
WEE1 P30291 1/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
KCNH2 Q12809 1/20 0.34
ALDH1A1 P00352 2/20 0.34
ERBB2 P04626 1/20 0.34
ALDH1A2 O94788 1/20 0.34
ALDH1A3 P47895 1/20 0.34
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CCNE1 P24864 1/20 0.33
CDK2 P24941 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 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
SCHEMBL8287507 0.89 PDE11A (0.59) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8285287 0.89 PDE11A (0.63) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8287500 0.88 PDE11A (0.57) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8287847 0.86 PDE11A (0.60) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8287476 0.86 PDE11A (0.56) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8285254 0.85 PDE11A (0.59) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8287479 0.85 PDE11A (0.57) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8285270 0.84 PDE11A (0.58) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8285142 0.84 PDE11A (0.60) PDE11AMAPTMEN1KMT2ALMNA
SCHEMBL8285283 0.84 PDE11A (0.57) PDE11AMAPTMEN1KMT2ALMNA

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