SCHEMBL8083940

SCHEMBL8083940

CCC(C)OP(=O)(O)CNc1cc(OCCOc2ccc(Cl)cc2)c(C(F)(F)F)cc1N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RHOC P08134 1/20 0.36
RHOA P61586 1/20 0.36
FDPS P14324 2/20 0.33
NPSR1 Q6W5P4 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DRD2 P14416 2/20 0.32
PPARG P37231 2/20 0.32
PPARA Q07869 2/20 0.32
PPARD Q03181 1/20 0.32
NPC1 O15118 1/20 0.31
KMT2A Q03164 3/20 0.31
MEN1 O00255 2/20 0.31
KCNH2 Q12809 1/20 0.30
DDR1 Q08345 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30

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
SCHEMBL8098482 0.87 MAPT (0.39) RHOCRHOANPC1KMT2AMEN1
SCHEMBL8098738 0.83 CYP1A2 (0.33) KCNH2
SCHEMBL8083938 0.82 RHOC (0.35) RHOCRHOAL3MBTL1DRD2NPC1
SCHEMBL8083652 0.81 PPARG (0.36) PPARGPPARDKMT2AMEN1MAPT
SCHEMBL8098272 0.81 UBE2M (0.34) NPSR1L3MBTL1PPARGPPARAPPARD
SCHEMBL8098790 0.78 NPSR1 (0.36) NPSR1L3MBTL1KDM4EALDH1A1LMNA
SCHEMBL8090776 0.78 PTGER4 (0.38) PPARGKMT2AMEN1KDM4EALDH1A1
SCHEMBL8083716 0.77 AKR1C3 (0.37) PPARGNPC1KMT2AMEN1KDM4E
SCHEMBL7920418 0.76 HDAC1 (0.38) NPC1KDM4EALDH1A1MAPTHPGD
SCHEMBL8342163 0.72 SERPINE1 (0.37) NPSR1NPC1KDM4EALDH1A1LMNA

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-6136805-A Quinoxaline dione derivatives, their production and their use in medicaments SCNERING AKTIENGESELLSCHAFT (DE) 2000-10-24 US disclosed