SCHEMBL6856635

SCHEMBL6856635

N#CCCC12CCC(C(=O)O)(CC1)CC2

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.32
CYP4A11 Q02928 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL12251758 0.72 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL3375229 0.72 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL20162490 0.72 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL8011488 0.72 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL4320105 0.71 CYP4F2 (0.38) CYP4F2CYP4A11
SCHEMBL28549876 0.69 CYP2C19 (0.47) CYP4F2CYP4A11MEN1KMT2A
SCHEMBL10336598 0.69 CCR2 (0.39) CYP4F2CYP4A11MEN1KMT2A
SCHEMBL893183 0.69 FFAR3 (0.44)
SCHEMBL20944070 0.69 FFAR3 (0.32) CYP4F2CYP4A11
SCHEMBL8220974 0.67 FFAR3 (0.36) CYP4F2CYP4A11

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
WO-2011063268-A2 NOVEL SYNTHETIC METHODS BIOGEN IDEC MA INC (US) 2011-05-26 WO disclosed