SCHEMBL31536367

SCHEMBL31536367

COC(=O)[C@]1(C)NS(=O)(=O)c2ccccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.36
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
POLB P06746 3/20 0.36
HPGD P15428 2/20 0.36
HSD17B10 Q99714 2/20 0.36
HTT P42858 2/20 0.36
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
GAA P10253 1/20 0.32
ITGA4 P13612 1/20 0.32
CA12 O43570 2/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA4 P22748 2/20 0.32
CA7 P43166 2/20 0.32
CA9 Q16790 2/20 0.32
PDK2 Q15119 1/20 0.32
PDK4 Q16654 1/20 0.32

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
SCHEMBL31536397 0.82 NR4A2 (0.37) KMT2AMEN1HTTGAACA12
SCHEMBL31536428 0.80 CA12 (0.40) KMT2AKDM4EALDH1A1POLBMAPT
SCHEMBL31536415 0.80 SMN1; SMN2 (0.39) KMT2AMEN1ALDH1A1LMNACA12
SCHEMBL31536391 0.80 CA1 (0.34) CA12CA1CA2CA4CA7
SCHEMBL31536381 0.79 TSHR (0.42) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL31536393 0.78 PKM (0.35) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL31536409 0.77 KIF11 (0.36) KMT2AMEN1ALDH1A1POLBHSD17B10
SCHEMBL31536374 0.77 NR4A2 (0.33) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL31536394 0.75 ALOX5 (0.35) KMT2AMEN1KDM4EALDH1A1POLB
SCHEMBL31536375 0.75 NCEH1 (0.35) KMT2AMEN1KDM4EALDH1A1POLB

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-119707855-A Optically active amine derivative and asymmetric alkyl synthesis method and application thereof 西南大学 2025-03-28 CN disclosed