SCHEMBL29023883

SCHEMBL29023883

O=S(=O)(Nc1ccc(Br)cn1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
POLB P06746 1/20 0.67
ALDH1A1 P00352 6/20 0.63
KDM4E B2RXH2 2/20 0.63
LMNA P02545 1/20 0.56
BRD4 O60885 1/20 0.55
MAPT P10636 2/20 0.53
HTT P42858 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
PKM P14618 1/20 0.52
GAA P10253 1/20 0.51
EDNRA P25101 1/20 0.51
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50

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
SCHEMBL2927789 0.84 ALDH1A1 (0.83) MEN1KMT2AALDH1A1KDM4ELMNA
SCHEMBL1267178 0.80 ALDH1A1 (0.59) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL30354961 0.80 POLB (0.67) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL29967435 0.80 POLB (1.00) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL29967697 0.80 ALDH1A1 (0.72) KMT2APOLBALDH1A1KDM4EMAPT
SCHEMBL29151336 0.80 POLB (0.67) KMT2APOLBALDH1A1KDM4ELMNA
SCHEMBL16177989 0.80 ALDH1A1 (0.72) KMT2APOLBALDH1A1KDM4EMAPT
SCHEMBL29023902 0.80 POLB (1.00) MEN1KMT2APOLBALDH1A1KDM4E
SCHEMBL1093189 0.80 POLB (0.67) POLBALDH1A1BRD4PKMGAA
SCHEMBL22088467 0.78 EDNRA (0.56) MEN1KMT2APOLBALDH1A1KDM4E

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-115124459-A Method for selectively nitrating N- (2-pyridyl) benzene sulfonamide compound 宁波大学 2022-09-30 CN disclosed