SCHEMBL4609162

SCHEMBL4609162

CNC(=O)c1ccc(C(=O)N2CCCC3CCCC=C32)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
PLK1 P53350 2/20 0.38
ALDH1A1 P00352 3/20 0.38
L3MBTL3 Q96JM7 2/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
LMNA P02545 1/20 0.37
HIF1A Q16665 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPT P10636 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL3456155 0.82 ALDH1A1 (0.52) HPGDSMN1; SMN2ALDH1A1L3MBTL3LMNA
SCHEMBL5946914 0.82 HPGD (0.54) HPGDTSHRSMN1; SMN2ALDH1A1L3MBTL3
SCHEMBL3814820 0.79 MEN1 (0.49) HPGDHTTALDH1A1HDAC6LMNA
SCHEMBL3815128 0.76 GRIA2 (0.36) HPGDSMN1; SMN2HRH3ALDH1A1LMNA
SCHEMBL1393042 0.76 FPR1 (0.43) L3MBTL3HDAC8HDAC6L3MBTL1
SCHEMBL3264153 0.74 NOTUM (0.36) HPGDALDH1A1LMNAHIF1AHSD11B1
SCHEMBL240569 0.74 GAA (0.42) ALDH1A1LMNAL3MBTL1KDM4EMEN1
SCHEMBL1393330 0.74 NOTUM (0.50)
SCHEMBL3810932 0.74 HDAC1 (0.47) HTTSMN1; SMN2HDAC6MEN1KMT2A
SCHEMBL3809230 0.74 HRH3 (0.39) HPGDSMN1; SMN2HRH3ALDH1A1LMNA

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
EP-1948190-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2008-07-30 EP disclosed
WO-2007051810-A2 PHARMACEUTICAL USE OF SUBSTITUTED AMIDES TRANSTECH PHARMA (US) 2007-05-10 WO disclosed