SCHEMBL10952007

SCHEMBL10952007

CCCCCCCCCCN(CC(=O)O)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
PAX8 Q06710 2/20 0.55
JAK2 O60674 1/20 0.55
PLA2G2A P14555 1/20 0.50
BLM P54132 1/20 0.50
CNR2 P34972 3/20 0.49
ICMT O60725 2/20 0.49
ALB P02768 2/20 0.49
TACR1 P25103 1/20 0.47
TP53 P04637 2/20 0.44
EPHX1 P07099 3/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 1/20 0.43
GPX4 P36969 1/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42

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
SCHEMBL10956818 1.00 NPC1 (0.55) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL4744062 1.00 NPC1 (0.55) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL10951817 1.00 NPC1 (0.55) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL3982113 1.00 NPC1 (0.55) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL6326806 0.98 NPC1 (0.53) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL3342781 0.93 CNR2 (0.48) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL430658 0.86 TP53 (0.49) NPC1RAB9APAX8JAK2CNR2
SCHEMBL7643003 0.85 PLA2G2A (0.46) NPC1RAB9APAX8JAK2PLA2G2A
SCHEMBL9122844 0.85 GPR84 (0.55) NPC1RAB9APAX8JAK2ICMT
SCHEMBL9124134 0.85 NPC1 (0.54) NPC1RAB9APAX8JAK2CNR2

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
US-4492683-A Method for inhibiting the growth of fungi with phenyl glycine compounds BUFFALO COLOR CORPORATION (US) 1985-01-08 US claimed
US-4492683-A Method for inhibiting the growth of fungi with phenyl glycine compounds BUFFALO COLOR CORPORATION (US) 1985-01-08 US disclosed