SCHEMBL14899249

SCHEMBL14899249

O=C1OCCN1c1ccccc1O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
POLB P06746 1/20 0.42
NOTUM Q6P988 1/20 0.39
NAAA Q02083 5/20 0.38
FAAH O00519 3/20 0.38
DGAT1 O75907 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HTT P42858 1/20 0.38
TNKS O95271 1/20 0.37
KMT2A Q03164 3/20 0.37
BRD4 O60885 1/20 0.37
MEN1 O00255 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
SCHEMBL29557633 0.80 KEAP1 (0.44) GAAKDM4ENOTUMNAAAFAAH
SCHEMBL138181 0.80 KEAP1 (0.44) GAAKDM4ENOTUMNAAAFAAH
SCHEMBL3361698 0.79 MGLL (0.43) KDM4ENOTUMNAAAFAAHTNKS
SCHEMBL8502875 0.79 MGLL (0.43) KDM4ENOTUMNAAAFAAHTNKS
SCHEMBL4543332 0.79 DDB1 (0.50) L3MBTL1KMT2AMEN1
SCHEMBL2750210 0.79 MEN1 (0.56) KDM4EPOLBL3MBTL1KMT2AMEN1
SCHEMBL31518544 0.78 L3MBTL1 (0.49) GAAPOLBNOTUMNAAAFAAH
SCHEMBL7823337 0.77 KEAP1 (0.42) GAAKDM4EL3MBTL1TNKSKMT2A
SCHEMBL19127710 0.77 KMT2A (0.40) KDM4ENOTUMNAAAFAAHTNKS
SCHEMBL7814732 0.77 KEAP1 (0.46) GAAPOLBL3MBTL1KMT2A

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
US-8431607-B2 Compounds and compositions as inhibitors of cannabinoid receptor 1 activity IRM LLC, A DELAWARE LIMITED LIABILITY COMPANY (BM) 2013-04-30 US disclosed