SCHEMBL7647876

SCHEMBL7647876

OCC(O)CC1CC2CCC1C2

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
OPRK1 P41145 5/20 0.33
PER2 O15055 1/20 0.32
CRY1 Q16526 1/20 0.32
CRY2 Q49AN0 1/20 0.32
HSD11B1 P28845 2/20 0.32
POLB P06746 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
P2RX7 Q99572 1/20 0.30
HPGD P15428 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
SCHEMBL9908396 0.82 MEN1 (0.38) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL9908407 0.81 MEN1 (0.35) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL11596492 0.78 OPRK1 (0.37) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL13706699 0.78 OPRK1 (0.39) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL32689229 0.76 MEN1 (0.34) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL14694312 0.75 MEN1 (0.32) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL21626126 0.74 OPRK1 (0.37) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL112908 0.74 OPRK1 (0.37) MEN1NPC1RAB9AKMT2AOPRK1
SCHEMBL3332068 0.73
SCHEMBL3332078 0.73

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
WO-2002051395-A1 TREATMENT OF NEURODEGENERATIVE DISEASES CODON PHARMACEUTICALS, INC. (US) 2002-07-04 WO claimed
WO-1998055085-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS CODON PHARMACEUTICALS, INC. (US) 1998-12-10 WO claimed