SCHEMBL7027339

SCHEMBL7027339

Oc1ccc(-c2c[nH]cn2)c(O)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 3/20 0.43
ESR1 P03372 5/20 0.40
ALOX5 P09917 1/20 0.39
MAPT P10636 4/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 2/20 0.38
ALDH1A1 P00352 2/20 0.38
POLB P06746 2/20 0.38
NFKB1 P19838 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
AMY1A P0DUB6 1/20 0.37
ESR2 Q92731 2/20 0.37
GAA P10253 2/20 0.37
RUNX1 Q01196 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
SCHEMBL1949938 0.87 GAA (0.41) ESR1MAPTNPC1HPGDHTT
SCHEMBL1502109 0.78 IDO1 (0.47) MAPTRAB9AMEN1KMT2ASMN1; SMN2
SCHEMBL1501981 0.74 MAPT (0.45) ESR1MAPTNPC1RAB9AMEN1
SCHEMBL1949537 0.73 IDO1 (0.50) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL12676730 0.73 IDO1 (0.50) MAPTNPC1RAB9AMEN1KMT2A
SCHEMBL2226829 0.72 ESR2 (0.58) NPC1RAB9AMEN1KMT2AHPGD
SCHEMBL1501914 0.72 HSD17B1 (0.58)
SCHEMBL26259398 0.71 MEN1 (0.33) MEN1KMT2ASMN1; SMN2HTT
SCHEMBL12676617 0.69 ALOX5 (0.46) ALOX5MAPTMEN1KMT2AHPGD
SCHEMBL1951809 0.69 HPGD (0.38) MAPTMEN1KMT2AHPGDHTT

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-20030226769-A1 Kit for assaying saccharified protein SODE KOJI (JP) 2003-12-11 US disclosed