SCHEMBL11345563

SCHEMBL11345563

Cc1c(S(=O)(=O)O)c(N)cc2ccc(O)c(O)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 6/20 0.40
HSD17B10 Q99714 5/20 0.40
ALDH1A1 P00352 4/20 0.40
NT5E P21589 2/20 0.37
GLO1 Q04760 1/20 0.36
CDK2 P24941 1/20 0.36
NQO1 P15559 1/20 0.35
RNASEH1 O60930 1/20 0.35
GPR35 Q9HC97 1/20 0.35
ATG4B Q9Y4P1 1/20 0.35
MAPT P10636 3/20 0.35
ALOX15 P16050 3/20 0.35
KDM4E B2RXH2 2/20 0.35
LMNA P02545 2/20 0.35
RECQL P46063 2/20 0.35
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
HPGD P15428 1/20 0.35
ALOX12 P18054 1/20 0.35
APEX1 P27695 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
SCHEMBL28054299 0.73 ALDH1A1 (0.46) HSD17B10ALDH1A1NT5ENQO1MAPT
SCHEMBL28020173 0.71 PTPN11 (0.41) PTPN11HSD17B10ALDH1A1NT5ECDK2
SCHEMBL6535288 0.70 AURKA (0.47) HSD17B10ALDH1A1NT5ECDK2MAPT
SCHEMBL19730612 0.69 ALDH1A1 (0.48) PTPN11HSD17B10ALDH1A1NT5ENQO1
SCHEMBL28118185 0.69 NT5E (0.63) PTPN11HSD17B10ALDH1A1NT5EMAPT
SCHEMBL14001578 0.68 NT5E (0.61) PTPN11HSD17B10ALDH1A1NT5EMEN1
SCHEMBL428171 0.67 TSHR (0.39) HSD17B10ALDH1A1NT5ENQO1MAPT
SCHEMBL11810695 0.66 AURKA (0.42) HSD17B10ALDH1A1NT5ENQO1MAPT
SCHEMBL7831185 0.66 TTR (0.45) HSD17B10ALDH1A1NT5ECDK2NQO1
SCHEMBL5202112 0.65 TRPA1 (0.38) HSD17B10ALDH1A1NT5EGLO1MAPT

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-4261889-A TRIAZINE DYES FOR COTTON CIBA-GEIGY CORP. (US) 1981-04-14 US disclosed