SCHEMBL8301263

SCHEMBL8301263

CCOC(=O)C1CCN(C(=O)Nc2ccc(Br)cc2C(=O)NCc2ccc3c(c2)OCO3)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 5/20 0.50
GAA P10253 3/20 0.50
LMNA P02545 2/20 0.50
MAPK1 P28482 2/20 0.49
MAPT P10636 2/20 0.49
USP2 O75604 1/20 0.49
APEX1 P27695 1/20 0.49
KMT2A Q03164 1/20 0.49
CTDSP1 Q9GZU7 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
HSP90AA1 P07900 1/20 0.47
ALDH1A1 P00352 3/20 0.47
HPGD P15428 3/20 0.47
TSHR P16473 3/20 0.47
KDM4E B2RXH2 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PKM P14618 1/20 0.44
RXFP1 Q9HBX9 1/20 0.44

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
SCHEMBL8297193 0.91 POLB (0.58) POLBGAAMAPK1MAPTUSP2
SCHEMBL8291729 0.89 LMNA (0.51) POLBLMNAMAPK1KMT2ATDP1
SCHEMBL8436830 0.88 GAA (0.54) POLBGAALMNAKMT2AHSP90AA1
SCHEMBL8296702 0.83 TSHR (0.52) POLBGAALMNAMAPK1MAPT
SCHEMBL8299754 0.80 F10 (0.53) POLBGAALMNAMAPK1MAPT
SCHEMBL8292507 0.79 HPGD (0.48) POLBMAPK1MAPTUSP2APEX1
SCHEMBL8300681 0.79 GAA (0.60) POLBGAALMNAMAPK1MAPT
SCHEMBL8291728 0.79 HPGD (0.49) POLBGAALMNAKMT2AALDH1A1
SCHEMBL8300888 0.78 POLB (0.64) POLBGAALMNAMAPK1MAPT
SCHEMBL8566730 0.77 HPGD (0.47) POLBMAPK1MAPTUSP2APEX1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0686625-B1 ANTHRANILIC ACID DERIVATIVE EISAI CO LTD (JP) 1999-05-26 EP disclosed
EP-0686625-A1 ANTHRANILIC ACID DERIVATIVE Eisai Co., Ltd. (JP) 1995-12-13 EP disclosed