SCHEMBL8285121

SCHEMBL8285121

Cc1ccccc1Nc1cc(=O)c2cc(F)c(Cl)nc2n1-c1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
MAPT P10636 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
HPGD P15428 2/20 0.39
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39
THRB P10828 1/20 0.39
BLM P54132 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
UBA2 Q9UBT2 1/20 0.39
MAPK11 Q15759 1/20 0.38
MAPK14 Q16539 1/20 0.38
LMNA P02545 4/20 0.37
TP53 P04637 2/20 0.37
P2RX7 Q99572 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.35
HCAR1 Q9BXC0 1/20 0.34

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
SCHEMBL8287814 0.80 ALDH1A1 (0.32) ALDH1A1MAPTMEN1KMT2AL3MBTL1
SCHEMBL8287325 0.74 GAA (0.42) ALDH1A1MAPTGAAHPGDLMNA
SCHEMBL5872167 0.71 MAT2A (0.34) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL8285115 0.70 BPTF (0.36) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL8287801 0.70 ALDH1A2 (0.37) ALDH1A1MAPTKMT2AKDM4EL3MBTL1
SCHEMBL24474402 0.69 KRAS (0.39) MAPTKDM4EMAPK11MAPK14NPSR1
SCHEMBL8285132 0.69 APP (0.40) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL8287898 0.68 LMNA (0.38) ALDH1A1MAPTMEN1KMT2AKDM4E
SCHEMBL8287816 0.68 ALPL (0.40) KDM4ETP53NPC1RAB9ASMN1; SMN2
SCHEMBL24459972 0.66 KRAS (0.44) P2RX7MAT2A

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