SCHEMBL30913032

SCHEMBL30913032

CC1NS(=O)(=O)Oc2ccccc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.37
PARP1 P09874 1/20 0.33
MEN1 O00255 3/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HTR5A P47898 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
SLC40A1 Q9NP59 1/20 0.32
ADORA3 P0DMS8 1/20 0.32
AR P10275 1/20 0.32
HSD11B1 P28845 1/20 0.32
AKR1C3 P42330 1/20 0.32
ATM Q13315 1/20 0.32
LMNA P02545 1/20 0.31
USP2 O75604 1/20 0.31
BRD4 O60885 1/20 0.31
CREBBP Q92793 1/20 0.31

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
SCHEMBL30913026 0.77 KMT2A (0.36) KMT2AMEN1TSHRSMN1; SMN2NPSR1
SCHEMBL30913023 0.75 ALDH1A1 (0.49) KMT2AALDH1A1
SCHEMBL24074876 0.75 CA2 (0.39) AR
SCHEMBL24074874 0.75 CA2 (0.42) ALDH1A1TSHRARLMNA
SCHEMBL24075509 0.75 MAPT (0.39) MAOAMAOBAKR1C3
SCHEMBL23088767 0.74 KMT2A (0.47) KMT2AMEN1ALDH1A1TSHRMAOB
SCHEMBL29740756 0.74 KMT2A (0.47) KMT2AMEN1ALDH1A1TSHRMAOB
SCHEMBL30913033 0.73 MAOB (0.42) KMT2AMEN1ALDH1A1MAOBLMNA
SCHEMBL23088757 0.73 MAOB (0.42) KMT2AMEN1ALDH1A1MAOBLMNA
SCHEMBL24075587 0.72 GSTP1 (0.38)

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-118084822-A Preparation method for synthesizing chiral sulfonamide through nickel catalytic asymmetric reduction and chiral sulfonamide compound 中国科学院大连化学物理研究所 2024-05-28 CN disclosed