SCHEMBL29865510

SCHEMBL29865510

Nc1ccc(C(=O)NS(=O)(=O)C2CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.49
LMNA P02545 2/20 0.49
KMT2A Q03164 2/20 0.49
SCN9A Q15858 11/20 0.46
POLB P06746 2/20 0.46
PKM P14618 1/20 0.46
APEX1 P27695 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
SCN5A Q14524 6/20 0.45
KDM1A O60341 3/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
IKZF3 Q9UKT9 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
HIF1A Q16665 1/20 0.42

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
SCHEMBL17113311 0.83 OGG1 (0.47) SCN9ASCN5AKDM1A
SCHEMBL3808268 0.82 HDAC3 (0.50) MEN1LMNAKMT2ASCN9ASCN5A
SCHEMBL16361274 0.82 SCN9A (0.49) LMNASCN9ASCN5AKDM4E
Aniline SCHEMBL23611143 0.81 CACNA1B (0.52) MEN1LMNAKMT2APOLBPKM
SCHEMBL29625497 0.79 NPC1 (0.54) MEN1LMNAKMT2ASCN9ASCN5A
SCHEMBL29865596 0.78 FLT1 (0.56) MEN1KMT2APOLBTDP1CA1
SCHEMBL29386943 0.77 KDM1A (0.46) MEN1LMNAKMT2ASCN9ASCN5A
SCHEMBL25256495 0.76 RAB9A (0.47) MEN1LMNAKMT2ASCN9ASCN5A
SCHEMBL30034142 0.76 KDM1A (0.45) MEN1LMNAKMT2ASCN9APOLB
SCHEMBL16319349 0.75 MMP1 (0.55) MEN1LMNAKMT2ASCN9AMAPT

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-115066417-B Factor XIa inhibitors 上海京新生物医药有限公司 2025-05-02 CN disclosed
CN-115066417-A Factor XIa inhibitors 上海京新生物医药有限公司 2022-09-16 CN disclosed