SCHEMBL8966261

SCHEMBL8966261

CCOC(=O)Oc1cccc2ncc(-c3ccccc3)cc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 1/20 0.43
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
MAPT P10636 5/20 0.41
POLB P06746 3/20 0.41
PDGFRB P09619 1/20 0.41
PDGFRA P16234 1/20 0.41
TP53 P04637 1/20 0.41
ALDH1A1 P00352 6/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RXFP1 Q9HBX9 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TYMS P04818 1/20 0.40
PRNP P04156 3/20 0.40
HPGD P15428 3/20 0.40
TDP1 Q9NUW8 2/20 0.40
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL8966245 0.86 AXL (0.47) PSMB5PDGFRBPDGFRAKDM4EHPGD
SCHEMBL8967010 0.83 MET (0.44) PSMB5MAPTPDGFRBPDGFRAALDH1A1
SCHEMBL8966212 0.81 MET (0.45) PSMB5MAPTPDGFRBPDGFRAALDH1A1
SCHEMBL8911265 0.80 ALDH1A1 (0.53) NPC1RAB9AMAPTPOLBTP53
SCHEMBL8302290 0.76 MEN1 (0.45) RAB9AMAPTPOLBTP53ALDH1A1
SCHEMBL10440111 0.75 TYMS (0.46) RAB9AMAPTPOLBALDH1A1SMN1; SMN2
SCHEMBL8502972 0.75 PDGFRB (0.46) NPC1RAB9AMAPTPDGFRBPDGFRA
SCHEMBL9705890 0.74 NR3C2 (0.40) PSMB5NPC1RAB9AMAPTPOLB
SCHEMBL9463382 0.74 NR3C2 (0.51) MAPTTP53ALDH1A1SMN1; SMN2KDM4E
SCHEMBL8503300 0.72 KMT2A (0.45) RAB9AMAPTPDGFRBPDGFRAALDH1A1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0694534-A1 3-Substituted quinoline-5-carboxylic acid derivatives and processes for their preparation BAYER AG (DE) 1996-01-31 EP disclosed
EP-0452712-B1 4-Quinolyl-dihydropyridines, process for their prepatation and their use in medicaments BAYER AG (DE) 1995-04-19 EP disclosed
EP-0452712-A1 4-Quinolyl-dihydropyridines, process for their prepatation and their use in medicaments BAYER AG (DE) 1991-10-23 EP disclosed