SCHEMBL21935548

SCHEMBL21935548

O=C(c1cc(O)c(O)cc1O)c1cc(O)c(O)c(O)c1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.44
HPGD P15428 3/20 0.41
ALDH1A1 P00352 3/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
TSHR P16473 1/20 0.41
RECQL P46063 1/20 0.41
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CASP1 P29466 1/20 0.39
CYP2C19 P33261 1/20 0.39
PTPN1 P18031 1/20 0.38
SELL P14151 2/20 0.37
SELP P16109 2/20 0.37
APP P05067 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CA12 O43570 1/20 0.34

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
SCHEMBL8605862 0.91 HDAC1 (0.50) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL7897387 0.85 HPGD (0.50) HPGDALDH1A1ALOX15HSD17B10TDP1
SCHEMBL21935543 0.84 PTPN1 (0.48) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL21935532 0.84 PTPN1 (0.48) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL21935563 0.83 NPC1 (0.46) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL8649470 0.83 HDAC1 (0.60) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL21935547 0.81 PTPN1 (0.45) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL21935912 0.81 PTPN1 (0.50) HDAC1HPGDALDH1A1ALOX15HSD17B10
SCHEMBL21935871 0.80 HDAC1 (0.47) HDAC1HPGDALDH1A1ALOX15TSHR
SCHEMBL21935539 0.80 PTPN1 (0.46) HDAC1HPGDALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10894887-B2 Composition for forming film protecting against aqueous hydrogen peroxide solution NISSAN CHEMICAL CORPORATION (JP) 2021-01-19 US disclosed
US-20200131376-A1 COMPOSITION FOR FORMING FILM PROTECTING AGAINST AQUEOUS HYDROGEN PEROXIDE SOLUTION NISSAN CHEMICAL CORPORATION (JP) 2020-04-30 US disclosed