SCHEMBL3460346

SCHEMBL3460346

O=C(NCC1CCCCC1)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 2/20 0.62
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
NR4A2 P43354 1/20 0.56
FAAH O00519 1/20 0.56
CNR2 P34972 1/20 0.56
HDAC6 Q9UBN7 1/20 0.56
GPR132 Q9UNW8 2/20 0.56
NR1H4 Q96RI1 1/20 0.55
POLB P06746 1/20 0.55
MAOB P27338 1/20 0.54
PTPN1 P18031 1/20 0.53
SPHK2 Q9NRA0 1/20 0.53
SPHK1 Q9NYA1 1/20 0.53
GUSB P08236 1/20 0.53
NPC1 O15118 1/20 0.53
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C9 P11712 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
SCHEMBL8985626 0.90 SMPD1 (0.60) SMPD1MEN1KMT2ANR4A2HDAC6
SCHEMBL5968109 0.83 SGMS2 (0.55) MEN1KMT2APOLBMAOBNPC1
SCHEMBL2858452 0.82 MEN1 (0.51) MEN1KMT2ACNR2HDAC6POLB
SCHEMBL13430713 0.81 BRD4 (0.56) MEN1KMT2AHDAC6POLB
SCHEMBL10722330 0.81 MEN1 (0.81) MEN1KMT2AHDAC6POLBNPC1
SCHEMBL1123392 0.80 GPR132 (0.78) SMPD1GPR132
SCHEMBL25123079 0.79 SMN1; SMN2 (0.76) MEN1KMT2AHDAC6POLBNPC1
SCHEMBL4522241 0.79 SMN1; SMN2 (0.76) MEN1KMT2AHDAC6POLBNPC1
SCHEMBL8395225 0.79 SMN1; SMN2 (0.76) MEN1KMT2AHDAC6POLBNPC1
SCHEMBL4195142 0.79 MEN1 (0.66) MEN1KMT2AHDAC6POLBNPC1

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-2239012-A2 Pharmaceutical use of substituted amides High Point Pharmaceuticals, LLC (US) 2010-10-13 EP claimed