SCHEMBL9160225

SCHEMBL9160225

Nc1cc(O)c(N)c(N)c1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
GAA P10253 5/20 0.39
MAPT P10636 5/20 0.39
KDM4E B2RXH2 3/20 0.39
LMNA P02545 1/20 0.39
ALOX15 P16050 4/20 0.36
HSD17B10 Q99714 4/20 0.36
CYP3A4 P08684 1/20 0.36
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
HPGD P15428 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TSHR P16473 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL3731870 0.82 ALDH1A1 (0.39) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL28170935 0.79 PTK2 (0.41) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL30595512 0.79 ALOX15 (0.38) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL5329321 0.79 ALOX15 (0.38) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL2028742 0.78 PTK2 (0.47) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL6268650 0.77 ALOX15 (0.36) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL7266240 0.77 ALOX15 (0.36) ALDH1A1GAAMAPTKDM4ELMNA
SCHEMBL6854706 0.76 ALDH1A1 (0.39) ALDH1A1GAAMAPTKDM4ELMNA
Hydrochloric Acid SCHEMBL5160736 0.75 PTK2 (0.44) ALDH1A1GAAMAPTKDM4ELMNA
Sulfuric Acid SCHEMBL5162601 0.74 GAA (0.42) ALDH1A1GAAMAPTKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3238815-B1 COMPOSITE SEMIPERMEABLE MEMBRANE TORAY INDUSTRIES (JP) 2026-01-28 EP disclosed
US-10143976-B2 Composite semipermeable membrane TORAY INDUSTRIES, INC. (JP) 2018-12-04 US disclosed
US-20170368510-A1 COMPOSITE SEMIPERMEABLE MEMBRANE TORAY INDUSTRIES, INC. (JP) 2017-12-28 US disclosed
EP-3238815-A1 COMPOSITE SEMIPERMEABLE MEMBRANE Toray Industries, Inc. (JP) 2017-11-01 EP disclosed
EP-0431756-B1 Polyol and rigid polyurethane foam MITSUI TOATSU CHEMICALS (JP) 1995-04-05 EP disclosed
US-5246978-A Thermal insulation material; epoxy resin based, phenolic resin based or aromatic amine based polyol component MITSUI TOATSU CHEMICALS, INC. (JP) 1993-09-21 US disclosed
EP-0431756-A2 Polyol and rigid polyurethane foam MITSUI TOATSU CHEMICALS, Inc. (JP) 1991-06-12 EP disclosed