SCHEMBL8667482

SCHEMBL8667482

CCC(=O)OC(=O)NNC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.51
ALDH1A1 P00352 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
NPC1 O15118 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
RAB9A P51151 1/20 0.44
HPGD P15428 1/20 0.44
KDM4E B2RXH2 1/20 0.44
PKM P14618 1/20 0.44
GPR119 Q8TDV5 2/20 0.42
RECQL P46063 1/20 0.42
EPHX2 P34913 1/20 0.42
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41
STS P08842 1/20 0.41
KMT2A Q03164 1/20 0.41
USP2 O75604 1/20 0.40

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
SCHEMBL13208 0.86 EPHX1 (0.58) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL15951688 0.85 EPHX1 (0.52) EPHX1ALDH1A1L3MBTL1NPC1MAPT
Acetic Acid SCHEMBL25356110 0.83 EPHX1 (0.56) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL29150085 0.81 THRB (0.54) EPHX1ALDH1A1L3MBTL1KDM4EKMT2A
SCHEMBL12522609 0.81 EPHX1 (0.60) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL7881349 0.78 EPHX1 (0.52) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL22759160 0.77 EPHX1 (0.61) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL8621693 0.77 EPHX1 (0.58) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL1652106 0.77 STS (0.58) EPHX1ALDH1A1L3MBTL1NPC1MAPT
SCHEMBL10268244 0.76 EPHX1 (0.65) EPHX1ALDH1A1L3MBTL1NPC1MAPT

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-5760057-A ANTICOAGULANTS ZENECA LIMITED (GB) 1998-06-02 US disclosed