SCHEMBL28820240

SCHEMBL28820240

Cc1ccc(S(=O)(=O)N=CN2CCCCC2)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
GAA P10253 3/20 0.53
LMNA P02545 1/20 0.53
MEN1 O00255 3/20 0.53
ALDH1A1 P00352 9/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
PKM P14618 2/20 0.47
POLB P06746 3/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 1/20 0.45
HPGD P15428 1/20 0.45
KDM4E B2RXH2 2/20 0.44
TP53 P04637 1/20 0.44
GLA P06280 1/20 0.44
CYP3A4 P08684 1/20 0.44
MAPT P10636 1/20 0.44
ALOX12 P18054 1/20 0.44
NFKB1 P19838 1/20 0.44

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
SCHEMBL29751569 1.00 KMT2A (0.56) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL30250037 0.98 GAA (0.54) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL28820231 0.98 GAA (0.54) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL30776068 0.85 LMNA (0.50) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL30249965 0.85 KMT2A (0.73) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL28820221 0.85 KMT2A (0.73) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL30776064 0.81 MEN1 (0.54) KMT2AMEN1ALDH1A1SMN1; SMN2PKM
SCHEMBL30776037 0.80 LMNA (0.55) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL30776085 0.77 MEN1 (0.50) KMT2AGAALMNAMEN1ALDH1A1
SCHEMBL3543990 0.76 KMT2A (0.50) KMT2AGAALMNAMEN1ALDH1A1

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
CN-114920616-B Synthesis process of amidine compound 南京师范大学 2024-04-05 CN disclosed
CN-114920616-A Synthetic process of amidine compound 南京师范大学 2022-08-19 CN disclosed