SCHEMBL8879604

SCHEMBL8879604

Nc1cc(CCCCC(=O)NC23CC4CC(CC(C4)C2)C3)ccc1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.60
RAB9A P51151 2/20 0.60
PDE3B Q13370 1/20 0.54
PDE3A Q14432 1/20 0.54
P2RY12 Q9H244 1/20 0.54
HDAC3 O15379 1/20 0.49
HDAC4 P56524 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC7 Q8WUI4 1/20 0.49
HDAC2 Q92769 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC11 Q96DB2 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
HDAC9 Q9UKV0 1/20 0.49
HDAC5 Q9UQL6 1/20 0.49
EPHX2 P34913 7/20 0.48
KMT2A Q03164 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
HTT P42858 2/20 0.46

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
SCHEMBL8781669 0.93 NPC1 (0.53) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL8880502 0.89 NPC1 (0.65) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL8881016 0.88 NPC1 (0.67) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL8785064 0.83 NPC1 (0.55) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL9346993 0.81 NPC1 (0.56) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL12932018 0.78 NPC1 (0.94) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL15310176 0.76 NPC1 (1.00) NPC1RAB9AHDAC3HDAC4HDAC1
SCHEMBL10439126 0.74 NPC1 (0.58) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL8781836 0.74 THRB (0.48) NPC1RAB9APDE3BPDE3AP2RY12
SCHEMBL27951169 0.73 MAPT (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2

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
US-5614521-A NERVE GROWTH FACTOR SANKYO COMPANY, LIMITED (JP) 1997-03-25 US claimed
CN-1064273-A The new NGF that has generates the active benzene derivative of promotion SANKYO CO (JP) 1992-09-09 CN claimed
EP-0501656-A2 New benzene derivatives having (NGF) production-promoting activity Sankyo Company Limited (JP) 1992-09-02 EP claimed