SCHEMBL28835290

SCHEMBL28835290

CNc1ccc(S(=O)(=O)c2ccccc2C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCC9 O60706 2/20 0.56
ABCC8 Q09428 2/20 0.56
KCNJ11 Q14654 2/20 0.56
KCNJ8 Q15842 2/20 0.56
HSD11B1 P28845 2/20 0.53
HTR6 P50406 3/20 0.51
NAMPT P43490 6/20 0.50
CA12 O43570 2/20 0.48
CA2 P00918 2/20 0.48
CA1 P00915 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.42
CA9 Q16790 1/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
TSHR P16473 1/20 0.40
POLB P06746 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL10728063 0.81 ABCC9 (0.67) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL12336792 0.81 HTR6 (0.58) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL8964467 0.81 GAA (0.60) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL30893040 0.81 GAA (0.60) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL31092469 0.81 HTR6 (0.57) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL1713160 0.81 HTR6 (0.57) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL28305875 0.79 ABCC9 (0.64) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL6976640 0.79 HTR6 (0.61) ABCC9ABCC8KCNJ11KCNJ8HTR6
(Phenylsulfonyl)Benzene SCHEMBL6332793 0.79 HTR6 (0.61) ABCC9ABCC8KCNJ11KCNJ8HSD11B1
SCHEMBL7150552 0.78 HTR6 (0.51) ABCC9ABCC8KCNJ11KCNJ8HSD11B1

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-114870639-A Preparation method of polyaryletherketone hollow fiber solvent-resistant nanofiltration membrane with narrow pore size distribution 浙江大学 2022-08-09 CN claimed