SCHEMBL17635962

SCHEMBL17635962

C/C(=N/O)c1ccc(O)c(OC=O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
RAB9A P51151 2/20 0.41
KMT2A Q03164 2/20 0.41
SLC22A6 Q4U2R8 1/20 0.41
SLC22A8 Q8TCC7 1/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 2/20 0.40
POLB P06746 2/20 0.38
CASP3 P42574 1/20 0.38
GFER P55789 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MAPT P10636 3/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
HPGD P15428 2/20 0.37
TRIM24 O15164 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL16883832 0.84 GAA (0.42) GAARAB9AKMT2ASLC22A6SLC22A8
SCHEMBL13268873 0.80 GAA (0.63) GAARAB9AKMT2ASLC22A6SLC22A8
SCHEMBL17548941 0.80 GAA (0.63) GAARAB9AKMT2ASLC22A6SLC22A8
SCHEMBL28835077 0.75 CA12 (0.61) GAARAB9AKMT2ASLC22A6SLC22A8
SCHEMBL7097648 0.73 POLB (0.48) GAARAB9AKMT2AHTTPOLB
SCHEMBL14330300 0.73 POLB (0.48) GAARAB9AKMT2AHTTPOLB
SCHEMBL13927323 0.73 POLB (0.48) GAARAB9AKMT2AHTTPOLB
SCHEMBL12374357 0.72 TRPA1 (0.46) GAAKMT2AMEN1HTTMAPT
SCHEMBL3037420 0.71 MAOB (0.54) GAARAB9AKMT2AMEN1HTT
SCHEMBL17635961 0.70 SMPD1 (0.45) GAARAB9AKMT2ASLC22A6SLC22A8

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
EP-3001472-A1 ORGANIC SEMICONDUCTOR COMPOSITION, ORGANIC THIN-FILM TRANSISTOR, ELECTRONIC PAPER, AND DISPLAY DEVICE Fujifilm Corporation (JP) 2016-03-30 EP disclosed