SCHEMBL6912905

SCHEMBL6912905

BCc1cc(F)ccc1OC

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 14/20 0.46
SLC6A4 P31645 14/20 0.46
SLC6A3 Q01959 14/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
HPGD P15428 1/20 0.45
KMT2A Q03164 1/20 0.45
KDM4E B2RXH2 1/20 0.44
KDM1A O60341 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
NFE2L2 Q16236 1/20 0.43
PKM P14618 1/20 0.42

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
SCHEMBL4625651 0.83 SLC6A4 (0.49) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL12844526 0.82 HMGCR (0.53) SLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL321697 0.81 KDM4E (0.53) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL30785121 0.81 KDM4E (0.53) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL1663130 0.79 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL1714408 0.79 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL2908313 0.79 PDE4A (0.50) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL16892264 0.79 ALDH1A1 (0.53) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1
SCHEMBL31119318 0.79 SLC6A2 (0.54) SLC6A2SLC6A4SLC6A3
SCHEMBL16935949 0.79 SLC6A2 (0.46) SLC6A2SLC6A4SLC6A3MEN1ALDH1A1

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-2011046771-A1 SUBSTITUTED PIPERIDINES THAT INCREASE p53 ACTIVITY AND THE USES THEREOF SCHERING CORPORATION (US) 2011-04-21 WO disclosed