SCHEMBL1666875

SCHEMBL1666875

Nc1ccccc1CC(=O)NCC1CCCCC1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.41
HPGD P15428 2/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
F2 P00734 1/20 0.37
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
HTR1A P08908 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
EPHX2 P34913 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
SCHEMBL9939308 0.74 TAAR1 (0.50) TAAR1HPGDSMN1; SMN2F2NPC1
SCHEMBL24576508 0.73 PEPD (0.44) TAAR1ALDH1A1
SCHEMBL9516971 0.73 EPHX2 (0.62) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL6962946 0.70 ALDH1A1 (0.58) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL15099942 0.69 HPGD (0.44) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL11893591 0.69 HPGD (0.44) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL11893590 0.69 HPGD (0.44) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL1666286 0.68 SLC6A2 (0.40) TAAR1HPGDKDM4EALDH1A1HSD17B10
SCHEMBL14278969 0.68 TAAR1 (0.42) TAAR1HPGDMEN1KMT2ASMN1; SMN2
SCHEMBL24576503 0.67 TAAR1 (0.42) TAAR1HPGDSMN1; SMN2RAB9A

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-2485728-A1 WNT PATHWAY ANTAGONISTS Siena Biotech S.p.a. (IT) 2012-08-15 EP disclosed
WO-2011042145-A1 WNT PATHWAY ANTAGONISTS SIENA BIOTECH S.P.A. (IT) 2011-04-14 WO disclosed