SCHEMBL28700807

SCHEMBL28700807

CC(=O)N1CCc2cccc(NS(=O)(=O)c3ccc(C)cc3)c21

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 2/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ ALDH1A1 P00352 3/20 0.54
▸ LMNA P02545 4/20 0.53
▸ PKM P14618 3/20 0.53
▸ TSHR P16473 2/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ NOTUM Q6P988 1/20 0.50
▸ MAPT P10636 2/20 0.48
▸ KMO O15229 1/20 0.48
▸ FFAR4 Q5NUL3 1/20 0.47
▸ USP2 O75604 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ NOD2 Q9HC29 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ TP53 P04637 1/20 0.46
▸ TRIM24 O15164 1/20 0.46

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
SCHEMBL29449739 1.00 KMT2A (0.55) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL28700808 0.93 POLB (0.52) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL28690031 0.89 LMNA (0.52) KMT2AMEN1LMNAPKMTSHR
SCHEMBL29449745 0.89 LMNA (0.60) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL28710227 0.89 LMNA (0.60) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL29449722 0.87 TRIM24 (0.61) KMT2AALDH1A1LMNAPKMTSHR
SCHEMBL28934090 0.87 TRIM24 (0.61) KMT2AALDH1A1LMNAPKMTSHR
SCHEMBL28705511 0.87 UQCRB (0.51) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL28694488 0.86 KMT2A (0.58) KMT2AMEN1ALDH1A1LMNAPKM
SCHEMBL28710293 0.83 KMT2A (0.55) KMT2AMEN1ALDH1A1LMNAPKM

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-110218172-B Method for preparing N-aryl sulfonamide from indoline and aryl sulfonamide 常州大学 2022-03-22 — — CN disclosed
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