SCHEMBL17787263

SCHEMBL17787263

Nc1cc(C(c2ccc(OCCO)c(N)c2)(C(F)(F)F)C(F)(F)F)ccc1OCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.38
L3MBTL1 Q9Y468 4/20 0.38
ATM Q13315 2/20 0.38
LMNA P02545 1/20 0.38
PRSS1 P07477 8/20 0.38
KDM4E B2RXH2 2/20 0.36
MEN1 O00255 2/20 0.36
USP2 O75604 2/20 0.36
ALDH1A1 P00352 2/20 0.36
CASP1 P29466 2/20 0.36
KMT2A Q03164 2/20 0.36
TP53 P04637 2/20 0.36
POLB P06746 2/20 0.36
GAA P10253 1/20 0.36
HTT P42858 1/20 0.36
CASP7 P55210 1/20 0.36
RAB9A P51151 1/20 0.35
NPSR1 Q6W5P4 1/20 0.33
IDO1 P14902 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL18072321 0.89 L3MBTL1 (0.42) MAPTL3MBTL1ATMLMNAPRSS1
SCHEMBL19174974 0.83 L3MBTL1 (0.52) MAPTL3MBTL1ATMLMNAPRSS1
SCHEMBL17787401 0.75 L3MBTL1 (0.39) MAPTL3MBTL1ATMLMNAPRSS1
SCHEMBL17787262 0.72 CYP3A4 (0.50) LMNAKDM4EMEN1ALDH1A1KMT2A
SCHEMBL9443798 0.72 L3MBTL1 (0.53) MAPTL3MBTL1ATMLMNAMEN1
SCHEMBL6538679 0.71 GAA (0.44) MAPTL3MBTL1ATMLMNAALDH1A1
SCHEMBL35916 0.71 MAPT (0.65) MAPTATMPRSS1KDM4EMEN1
SCHEMBL29358757 0.71 MAPT (0.65) MAPTATMPRSS1KDM4EMEN1
SCHEMBL6829506 0.70 PRSS1 (0.47) MAPTATMPRSS1KDM4EMEN1
SCHEMBL4943546 0.70 CYP3A4 (0.54) LMNAKDM4EMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170174833-A1 HIGH-FLUIDITY POLYCARBONATE COPOLYMER, PROCESS FOR PRODUCTION HIGHLY POLYMERIZED AROMATIC POLYCARBONATE RESIN AND AROMATIC POLYCARBONATE COMPOUND MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-06-22 US disclosed
US-20160264726-A1 HIGH-FLUIDITY POLYCARBONATE COPOLYMER, PROCESS FOR PRODUCTION HIGHLY POLYMERIZED AROMATIC POLYCARBONATE RESIN AND AROMATIC POLYCARBONATE COMPOUND MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-09-15 US disclosed
US-9353216-B2 High-fluidity polycarbonate copolymer, process for production highly polymerized aromatic polycarbonate resin and aromatic polycarbonate compound MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2016-05-31 US disclosed