SCHEMBL8450956

SCHEMBL8450956

CC/C=C/CCC[C@H]1CC[C@H]([C@H]2CC[C@H](CCc3cc(F)c(C(F)(F)F)c(F)c3)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DAO P14920 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
SCHEMBL8451139 0.96 DAO (0.31) DAO
SCHEMBL8446833 0.96 DAO (0.33) DAO
SCHEMBL8446757 0.93 DAO (0.32) DAO
SCHEMBL8448945 0.93 DAO (0.33) DAO
SCHEMBL8451837 0.93 DAO (0.33) DAO
SCHEMBL8453948 0.89 DAO (0.31) DAO
SCHEMBL8451711 0.89 DAO (0.32) DAO
SCHEMBL8454009 0.89
SCHEMBL8446712 0.89 DAO (0.33) DAO
SCHEMBL8451068 0.89 DAO (0.35) DAO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0647696-B1 Cyclohexane derivative CHISSO CORP (JP) 1999-04-21 EP disclosed
EP-0647696-A1 Cyclohexane derivative Chisso Corporation (JP) 1995-04-12 EP disclosed
US-5382379-A Cyclohexane derivative CHISSO CORPORATION (JP) 1995-01-17 US disclosed