SCHEMBL21935554

SCHEMBL21935554

O=C(c1cc(O)c(O)c(O)c1O)c1c(O)ccc(O)c1O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.53
SELL P14151 1/20 0.47
SELP P16109 1/20 0.47
PTPN1 P18031 1/20 0.43
HSD17B14 Q9BPX1 2/20 0.38
TERT O14746 1/20 0.38
PIK3CA P42336 4/20 0.37
HPGD P15428 3/20 0.36
ALOX15 P16050 3/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
RECQL P46063 2/20 0.36
HSD17B10 Q99714 2/20 0.36
MEN1 O00255 1/20 0.36
ALOX12 P18054 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP1A2 P05177 1/20 0.35
CYP2C9 P11712 1/20 0.35
CASP1 P29466 1/20 0.35

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
SCHEMBL21935543 0.87 PTPN1 (0.48) HDAC1SELLSELPPTPN1HPGD
SCHEMBL21935544 0.85 HDAC1 (0.59) HDAC1SELLSELPHSD17B14TERT
SCHEMBL9640036 0.84 CA1 (0.45) HDAC1SELLSELPPTPN1HSD17B14
SCHEMBL21935555 0.83 HDAC1 (0.68) HDAC1SELLSELPPTPN1HSD17B14
SCHEMBL9640017 0.83 HDAC1 (0.68) HDAC1SELLSELPHSD17B14TERT
SCHEMBL21935539 0.83 PTPN1 (0.46) HDAC1SELLSELPPTPN1HPGD
SCHEMBL21935532 0.83 PTPN1 (0.48) HDAC1SELLSELPPTPN1HPGD
SCHEMBL21935545 0.82 HDAC1 (0.47) HDAC1SELLSELPPTPN1HPGD
SCHEMBL21935536 0.82 HDAC1 (0.41) HDAC1SELLSELPPTPN1HSD17B14
SCHEMBL21935546 0.81 HDAC1 (0.47) HDAC1SELLSELPPTPN1HSD17B14

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