SCHEMBL12876990

SCHEMBL12876990

Bc1ccc(CO)cc1OCCOC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CBFB Q13951 1/20 0.39
SLC6A4 P31645 1/20 0.38
NPC1 O15118 2/20 0.38
POLB P06746 1/20 0.38
RAB9A P51151 1/20 0.38
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
KMT2A Q03164 2/20 0.34
HTT P42858 2/20 0.34
MEN1 O00255 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RECQL P46063 1/20 0.33
ALOX15 P16050 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ACHE P22303 1/20 0.33
PPARG P37231 1/20 0.33
PPARD Q03181 1/20 0.33
PPARA Q07869 1/20 0.33
HTR2C P28335 2/20 0.33

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
SCHEMBL1057005 0.84 NPC1 (0.47) CBFBSLC6A4NPC1POLBRAB9A
SCHEMBL12876995 0.83 SLC6A4 (0.38) SLC6A4NPC1POLBKMT2AHTT
SCHEMBL17129606 0.81 TSHR (0.41) CBFBSLC6A4NPC1POLBRAB9A
SCHEMBL11957393 0.80 L3MBTL1 (0.47) CBFBSLC6A4NPC1POLBRAB9A
SCHEMBL30808273 0.80 SLC6A4 (0.57) CBFBSLC6A4KMT2AHTTMEN1
SCHEMBL2408296 0.80 SLC6A4 (0.57) CBFBSLC6A4KMT2AHTTMEN1
SCHEMBL17129130 0.78 ALDH1A1 (0.41) CBFBSLC6A4NPC1POLBRAB9A
SCHEMBL20745053 0.76 SLC6A4 (0.53) CBFBSLC6A4NPC1KMT2AHTT
SCHEMBL26024874 0.76 L3MBTL1 (0.38) POLBKMT2AHTTL3MBTL1KDM4E
SCHEMBL796662 0.75 L3MBTL1 (0.37) SLC6A4NPC1POLBKMT2AMEN1

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-2011016468-A1 BENZYL PIPERIDINE COMPOUND 大日本住友製薬株式会社 (JP) 2011-02-10 WO disclosed