SCHEMBL13635336

SCHEMBL13635336

CCCC1CCC(C2CCC(C3Cc4cc(C)cc(F)c4O3)CC2)CC1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.35
FYN P06241 1/20 0.31
TLR4 O00206 1/20 0.30

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
SCHEMBL13635242 0.81 DRD2 (0.34) TLR4
SCHEMBL13635372 0.78 FYN (0.31) FYNTLR4
SCHEMBL14071143 0.73 BACE1 (0.33) GPR119
SCHEMBL14071400 0.72
SCHEMBL4383327 0.72 FYN (0.33) FYN
SCHEMBL4391852 0.72 TLR4 (0.34) FYNTLR4
SCHEMBL14281274 0.71 TLR4 (0.33) FYNTLR4
SCHEMBL9391219 0.70 FYN (0.44) FYNTLR4
SCHEMBL9391697 0.70 FYN (0.44) FYNTLR4
SCHEMBL9391704 0.70 FYN (0.44) FYNTLR4

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
EP-1409441-B1 INDANE COMPOUNDS WITH NEGATIVE DIELECTRIC ANISOTROPY MERCK PATENT GMBH (DE) 2009-11-18 EP disclosed