SCHEMBL5058437

SCHEMBL5058437

Cc1ccccc1OC(=O)[C@@H](C)N

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 1/20 0.46
PPARG P37231 1/20 0.43
BCHE P06276 1/20 0.43
SCN4A P35499 2/20 0.41
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
HPGD P15428 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
IRAK4 Q9NWZ3 1/20 0.40
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HTT P42858 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL5062924 1.00 TDP1 (0.46) TDP1L3MBTL1ATMPPARGBCHE
SCHEMBL1261877 0.85 MEN1 (0.51) TDP1L3MBTL1ATMPPARGBCHE
SCHEMBL1826831 0.83 TDP1 (0.47) TDP1L3MBTL1ATMPPARGBCHE
SCHEMBL28842455 0.81 TSHR (0.46) TDP1HPGDKMT2AIRAK4KDM4E
SCHEMBL7976424 0.81 KMT2A (0.51) L3MBTL1ATMBCHEKMT2AIRAK4
SCHEMBL1983875 0.81 TSHR (0.46) TDP1HPGDKMT2AIRAK4KDM4E
SCHEMBL3199566 0.81 KMT2A (0.51) L3MBTL1ATMBCHEKMT2AIRAK4
SCHEMBL8399530 0.81 CA1 (0.45) TDP1L3MBTL1ATMHPGDMEN1
SCHEMBL17502798 0.81 TDP1 (0.49) TDP1L3MBTL1ATMPPARGBCHE
SCHEMBL30605965 0.81 TDP1 (0.49) TDP1L3MBTL1ATMPPARGBCHE

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-20080254033-A1 Pharmaceutical Compositions Containing Antagonists to Lrp4, Lrp8 or Megalin for Treatment of Diseases FIVE PRIME THERAPEUTICS, INC. 2008-10-16 US disclosed