SCHEMBL30997286

SCHEMBL30997286

CCN(CC)CCCOc1cc2ncccc2cc1OC

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.64
PDGFRA P16234 1/20 0.64
ALDH1A1 P00352 2/20 0.50
EGFR P00533 3/20 0.45
TLR8 Q9NR97 2/20 0.42
TDP1 Q9NUW8 2/20 0.42
KDM4E B2RXH2 1/20 0.42
PDE10A Q9Y233 1/20 0.41
ACHE P22303 3/20 0.41
BCHE P06276 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
LMNA P02545 1/20 0.41
RAB9A P51151 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDR P35968 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41

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
SCHEMBL30997278 0.91 PDGFRB (0.62) PDGFRBPDGFRATLR8PDE10AMEN1
SCHEMBL30997309 0.87 PDGFRB (0.68) PDGFRBPDGFRAEGFRPDE10AMEN1
SCHEMBL8389350 0.83 PDGFRB (0.69) PDGFRBPDGFRAALDH1A1EGFRTLR8
SCHEMBL14540517 0.81 PDGFRB (0.43) PDGFRBPDGFRAALDH1A1TLR8TDP1
SCHEMBL30786377 0.81 PDGFRB (0.59) PDGFRBPDGFRAALDH1A1TLR8PDE10A
SCHEMBL4299023 0.80 PDGFRB (1.00) PDGFRBPDGFRAALDH1A1TLR8PDE10A
SCHEMBL29264931 0.79 ALDH1A1 (0.47) ALDH1A1EGFRKDM4EACHEBCHE
Hydrochloric Acid SCHEMBL29357672 0.79 PDGFRB (0.96) PDGFRBPDGFRAALDH1A1TLR8PDE10A
SCHEMBL15580155 0.79 EGFR (0.52) ALDH1A1EGFRTDP1KDM4EKDR
SCHEMBL28102697 0.76 PDGFRB (0.67) PDGFRBPDGFRAALDH1A1EGFRTLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118221577-A 2-Phenoxyquinoline derivative, and preparation method and application thereof 湖南中医药大学 2024-06-21 CN disclosed