SCHEMBL8905338

SCHEMBL8905338

CCCCC(=O)ONCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.56
POLB P06746 1/20 0.51
BCHE P06276 1/20 0.49
FAAH O00519 2/20 0.49
STING1 Q86WV6 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
KDM4E B2RXH2 1/20 0.48
RECQL P46063 1/20 0.48
HPGD P15428 1/20 0.48
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
PPID Q08752 1/20 0.47
ALDH1A1 P00352 1/20 0.46
CYP3A4 P08684 1/20 0.45
CYP2C19 P33261 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL17962571 0.90 EPHX2 (0.51) EPHX2POLBFAAHSTING1MEN1
SCHEMBL28239404 0.90 GAA (0.55) EPHX2STING1MEN1KMT2ARECQL
SCHEMBL15656106 0.90 MEN1 (0.53) EPHX2FAAHSTING1MEN1KMT2A
SCHEMBL28279506 0.87 EPHX2 (0.68) EPHX2FAAHCNR1CNR2
SCHEMBL21611670 0.86 STING1 (0.54) EPHX2STING1MEN1KMT2AKDM4E
SCHEMBL8037414 0.84 HPGD (0.52) EPHX2MEN1KMT2AKDM4ERECQL
SCHEMBL9543473 0.83 CNR1 (0.54) HPGDCNR1CNR2ALDH1A1
SCHEMBL6848244 0.83 PPID (0.51) EPHX2POLBBCHESTING1PPID
SCHEMBL8844080 0.82 STING1 (0.45) EPHX2POLBSTING1MEN1KMT2A
SCHEMBL27653287 0.82 L3MBTL1 (0.48) EPHX2POLBSTING1MEN1KMT2A

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-5703125-A MELT BLEND OF SOAP, SURFACTANT AND SOLVENT G. D. SEARLE & CO. (US) 1997-12-30 US disclosed