SCHEMBL8774443

SCHEMBL8774443

CCC[C@H]1CC[C@H](C2CCC(CCc3cnc(F)c(F)c3)CC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
TLR4 O00206 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
SCHEMBL8774436 1.00 PDGFRB (0.37) PDGFRBPDGFRATLR4
SCHEMBL8774452 1.00 PDGFRB (0.37) PDGFRBPDGFRATLR4
SCHEMBL8774462 1.00 PDGFRB (0.37) PDGFRBPDGFRATLR4
SCHEMBL8774426 0.96 PDGFRB (0.39) PDGFRBPDGFRA
SCHEMBL8774416 0.96 PDGFRB (0.39) PDGFRBPDGFRA
SCHEMBL8774029 0.92 PDGFRB (0.36) PDGFRBPDGFRA
SCHEMBL8774025 0.92 PDGFRB (0.36) PDGFRBPDGFRA
SCHEMBL8774037 0.92 PDGFRB (0.36) PDGFRBPDGFRA
SCHEMBL8774044 0.92 PDGFRB (0.36) PDGFRBPDGFRA
SCHEMBL8774198 0.92 PDGFRB (0.37) PDGFRBPDGFRA

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
EP-0519370-B1 Heterocyclic derivatives MERCK PATENT GMBH (DE) 1997-11-05 EP disclosed
EP-0519370-A2 Heterocyclic derivatives MERCK PATENT GmbH (DE) 1992-12-23 EP disclosed