SCHEMBL13985162

SCHEMBL13985162

CCC(C)(C)NC(=O)c1ccccc1C=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
POLB P06746 1/20 0.41
PKM P14618 1/20 0.40
NAMPT P43490 1/20 0.40
KMT2A Q03164 3/20 0.40
HPGD P15428 2/20 0.40
MEN1 O00255 2/20 0.40
ALDH1A1 P00352 2/20 0.40
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KDM4E B2RXH2 2/20 0.38
MAPT P10636 1/20 0.38

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
SCHEMBL13896664 0.88 NPSR1 (0.43) NPSR1L3MBTL1POLBKMT2AMEN1
SCHEMBL13985020 0.83 MAPT (0.50) L3MBTL1POLBKMT2AMEN1ALDH1A1
SCHEMBL14036676 0.79 NPSR1 (0.60) NPSR1L3MBTL1POLBKMT2AHPGD
SCHEMBL13590979 0.79 NPSR1 (0.64) NPSR1L3MBTL1POLBPKMKMT2A
SCHEMBL13973291 0.78 NPSR1 (0.58) NPSR1L3MBTL1POLBPKMNAMPT
SCHEMBL13973641 0.78 NPSR1 (0.58) NPSR1L3MBTL1POLBPKMNAMPT
SCHEMBL10330517 0.78 NPSR1 (0.58) NPSR1L3MBTL1POLBKMT2AHPGD
SCHEMBL22672843 0.78 NPSR1 (0.58) NPSR1L3MBTL1HPGDALDH1A1RAB9A
SCHEMBL18408979 0.78 L3MBTL1 (0.58) NPSR1L3MBTL1POLBHPGDALDH1A1
SCHEMBL10117106 0.77 KMT2A (0.49) L3MBTL1KMT2AHPGDMEN1ALDH1A1

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
WO-2009003029-A2 HIGH-TEMPERATURE SPIN-ON TEMPORARY BONDING COMPOSITIONS BREWER SCIENCE INC. (US) 2008-12-31 WO disclosed