SCHEMBL10868622

SCHEMBL10868622

[CH2]CCCCCCCCCCCCCCCC1CC2CCC1C2

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
KMT2A Q03164 1/20 0.33
EPHX2 P34913 1/20 0.32
OPRK1 P41145 3/20 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
SCHEMBL3447574 0.87 MEN1 (0.39) MEN1NPC1RAB9AKMT2AEPHX2
SCHEMBL10787062 0.83 MEN1 (0.37) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL4809603 0.80 ALOX5 (0.42) MEN1NPC1RAB9AKMT2AEPHX2
SCHEMBL4809821 0.80 ALOX5 (0.42) MEN1NPC1RAB9AKMT2AEPHX2
SCHEMBL20272491 0.80 MEN1 (0.33) MEN1NPC1RAB9AKMT2AEPHX2
SCHEMBL5469107 0.79 TSHR (0.33) MEN1NPC1RAB9AKMT2A
SCHEMBL25233759 0.78 MEN1 (0.41) MEN1NPC1RAB9AKMT2AEPHX2
SCHEMBL5468938 0.77 MEN1 (0.32) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL31033440 0.75 MEN1 (0.35) MEN1NPC1RAB9AKMT2AEPHX2
SCHEMBL9908423 0.75 MEN1 (0.39) MEN1NPC1RAB9AKMT2AEPHX2

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-0177696-A1 Macrolide alkylation process ABBOTT LABORATORIES (US) 1986-04-16 EP disclosed