SCHEMBL8286346

SCHEMBL8286346

Cc1cc(N2CCCC2)nc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 1/20 0.61
GAA P10253 5/20 0.43
KDM4E B2RXH2 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.42
ACHE P22303 1/20 0.42
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
HPGD P15428 1/20 0.41
ALOX12 P18054 1/20 0.41
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CB P42338 1/20 0.40
GALR2 O43603 2/20 0.39
GALR1 P47211 1/20 0.39
MAPT P10636 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
SLC2A1 P11166 2/20 0.38
TAAR1 Q96RJ0 2/20 0.37
TP53 P04637 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL8286342 0.99 PDE11A (0.60) PDE11AGAAKDM4EL3MBTL1ACHE
SCHEMBL8286344 0.94 PDE11A (0.64) PDE11AKDM4EL3MBTL1ALDH1A1POLB
SCHEMBL8285166 0.93 PDE11A (0.60) PDE11AKDM4EALDH1A1POLBPIK3CD
SCHEMBL5872109 0.91 PDE11A (0.75) PDE11AGAAKDM4EALDH1A1HPGD
SCHEMBL5871598 0.91 PDE11A (0.58) PDE11AKDM4EALDH1A1POLBHPGD
SCHEMBL5871831 0.89 PDE11A (0.57) PDE11AALDH1A1POLBPIK3CDPIK3CA
SCHEMBL8287870 0.88 PDE11A (0.56) PDE11AKDM4EALDH1A1PIK3CDPIK3CA
SCHEMBL8285164 0.87 PDE11A (0.55) PDE11AKDM4EALDH1A1PIK3CDPIK3CA
SCHEMBL8286050 0.86 PDE11A (0.54) PDE11AGAAPOLBMAPTKMT2A
SCHEMBL8286054 0.86 PDE11A (0.54) PDE11AKDM4EALDH1A1POLBHPGD

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