SCHEMBL5616615

SCHEMBL5616615

C#CC(O)(c1ccc(OC)c(F)c1)c1ccc(OC)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
KIF11 P52732 1/20 0.43
TUBB1 Q9H4B7 5/20 0.39
KDM1A O60341 2/20 0.37
ERN1 O75460 1/20 0.35

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
SCHEMBL30730695 0.84 CASP1 (0.44) LMNAMAPK1HTT
SCHEMBL30859286 0.83 MEN1 (0.43) LMNAMAPK1HTT
SCHEMBL30859290 0.83 MEN1 (0.43) LMNAMAPK1HTT
SCHEMBL27165401 0.83 MEN1 (0.43) LMNAMAPK1HTT
SCHEMBL16233081 0.80 LMNA (0.50) LMNAMAPK1HTTRAB9AKIF11
SCHEMBL8718999 0.79 KMT2A (0.39) LMNAHTTKIF11
SCHEMBL7816756 0.78 CYP19A1 (0.40) LMNAKIF11
SCHEMBL29149576 0.78 PDE4A (0.41) MAPK1HTTTUBB1
SCHEMBL10102337 0.78 CYP19A1 (0.44) LMNAHTTRAB9A
SCHEMBL6400299 0.78 CA12 (0.47) LMNAHTTRAB9ATUBB1

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
JP-2007091595-A MANUFACTURING METHOD OF NAPHTHOPYRAN COMPOUND TOKUYAMA CORP 2007-04-12 JP disclosed