SCHEMBL28293480

SCHEMBL28293480

Nc1ncncn1.O=S(=O)(O)c1ccc(S(=O)(=O)O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
TSHR P16473 4/20 0.56
NT5E P21589 1/20 0.56
HSP90AA1 P07900 1/20 0.54
KDM4E B2RXH2 3/20 0.52
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
HSD17B10 Q99714 3/20 0.42
TDP1 Q9NUW8 3/20 0.41
NAPRT Q6XQN6 1/20 0.39
POLB P06746 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 2/20 0.38
CASP6 P55212 2/20 0.38
CYP2C19 P33261 1/20 0.38
MAPT P10636 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HTT P42858 1/20 0.38
CA1 P00915 3/20 0.37
CA2 P00918 3/20 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
Sulfuric Acid SCHEMBL124985 0.84 HSP90AA1 (0.68) ALDH1A1TSHRNT5EHSP90AA1KDM4E
Sulfamate SCHEMBL8843758 0.82 HSP90AA1 (0.65) ALDH1A1TSHRNT5EHSP90AA1KDM4E
SCHEMBL29019058 0.81 TSHR (0.78) ALDH1A1TSHRNT5EKDM4ELMNA
SCHEMBL28268009 0.80 HSP90AA1 (0.62) ALDH1A1HSP90AA1KDM4ELMNASMN1; SMN2
SCHEMBL28050251 0.80 TSHR (0.62) ALDH1A1TSHRNT5EKDM4ELMNA
SCHEMBL8589061 0.78 LMNA (0.45) ALDH1A1TSHRNT5EKDM4ELMNA
SCHEMBL8589423 0.76 LMNA (0.43) ALDH1A1TSHRNT5EKDM4ELMNA
SCHEMBL29065907 0.75 TSHR (0.59) ALDH1A1TSHRNT5EKDM4ELMNA
SCHEMBL11676071 0.75 LMNA (0.42) ALDH1A1TSHRNT5EKDM4ELMNA
SCHEMBL7682081 0.74 ALDH1A1 (0.46) ALDH1A1TSHRNT5EKDM4ELMNA

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
CN-109641472-A Recording materials and recording sheet 日本曹达株式会社 2019-04-16 CN disclosed