SCHEMBL8287148

SCHEMBL8287148

O=c1cc(Nc2ccccc2)n(-c2ccccc2)c2nc(Oc3ccccc3)cc(C(F)(F)F)c12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.62
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
GAA P10253 1/20 0.35
WEE1 P30291 1/20 0.35
SLC22A12 Q96S37 1/20 0.34
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
NR1H2 P55055 1/20 0.33
NR1H3 Q13133 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
CCND2 P30279 1/20 0.33
CCND3 P30281 1/20 0.33
P2RX3 P56373 1/20 0.33
MAPK10 P53779 2/20 0.32
MAPK8 P45983 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
SCHEMBL8287174 0.88 PDE11A (0.58) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL8286349 0.87 PDE11A (0.61) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL8286352 0.86 PDE11A (0.60) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL8287101 0.86 PDE11A (0.60) PDE11AWEE1ADORA2AADORA1ALDH1A1
SCHEMBL8287155 0.85 PDE11A (0.59) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL8286350 0.84 PDE11A (0.58) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL8287215 0.84 PDE11A (0.61) PDE11ACYP3A4CYP2C9
SCHEMBL8286353 0.84 PDE11A (0.57) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL6879695 0.83 PDE11A (0.66) PDE11AMEN1KMT2AMAPTLMNA
SCHEMBL5872038 0.83 PDE11A (0.66) PDE11AMEN1KMT2AMAPTLMNA

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