SCHEMBL6461147

SCHEMBL6461147

CCCCCC1CC[C@@H]2C[C@H](c3ccc(-c4ccc(OC(F)F)c(F)c4)cc3)CC[C@@H]2C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 4/20 0.34
ESR2 Q92731 1/20 0.32
FPR2 P25090 1/20 0.31
NAAA Q02083 1/20 0.30
PDE4D Q08499 1/20 0.30
ESR1 P03372 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
SCHEMBL6461150 1.00 MGLL (0.34) MGLLESR2FPR2NAAAPDE4D
SCHEMBL6451260 0.99 MGLL (0.35) MGLLESR2FPR2
SCHEMBL7923263 0.99 MGLL (0.35) MGLLESR2FPR2
SCHEMBL6451263 0.99 MGLL (0.35) MGLLESR2FPR2
SCHEMBL7923267 0.99 MGLL (0.35) MGLLESR2FPR2
SCHEMBL6453033 0.97 ESR2 (0.34) MGLLESR2FPR2NAAAPDE4D
SCHEMBL6453032 0.97 ESR2 (0.34) MGLLESR2FPR2NAAAPDE4D
SCHEMBL6454390 0.93 CYP2C9 (0.33) MGLLFPR2NAAAPDE4D
SCHEMBL6454386 0.93 CYP2C9 (0.33) MGLLFPR2NAAAPDE4D
SCHEMBL6454644 0.91 MGLL (0.32) MGLLESR1

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
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed