SCHEMBL29464336

SCHEMBL29464336

Cc1cccc(C)c1-c1nc(NS(=O)(=O)c2cccc(N)n2)ccc1Br

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EDNRA P25101 1/20 0.38
HTT P42858 1/20 0.37
HSD11B1 P28845 6/20 0.36
ALDH1A1 P00352 4/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
KDM4E B2RXH2 4/20 0.35
HPGD P15428 2/20 0.35
HSD17B10 Q99714 2/20 0.35
LMNA P02545 1/20 0.34
PLAU P00749 1/20 0.34
SLC40A1 Q9NP59 1/20 0.33
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
GLA P06280 1/20 0.32
NPC1 O15118 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 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
SCHEMBL19927753 1.00 EDNRA (0.38) EDNRAHTTHSD11B1ALDH1A1L3MBTL1
SCHEMBL29464461 0.90 EDNRA (0.36) EDNRAHTTHSD11B1ALDH1A1L3MBTL1
SCHEMBL19928756 0.90 EDNRA (0.36) EDNRAHTTHSD11B1ALDH1A1L3MBTL1
SCHEMBL19925697 0.86 HSD11B1 (0.40) HTTHSD11B1ALDH1A1L3MBTL1KDM4E
SCHEMBL29464528 0.86 HSD11B1 (0.40) HTTHSD11B1ALDH1A1L3MBTL1KDM4E
SCHEMBL19968767 0.85 HSD11B1 (0.39) HSD11B1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL29464483 0.85 HSD11B1 (0.39) HSD11B1ALDH1A1L3MBTL1KDM4EHPGD
SCHEMBL29464411 0.83 ALDH1A1 (0.41) HSD11B1ALDH1A1L3MBTL1KDM4EHSD17B10
SCHEMBL19925181 0.83 ALDH1A1 (0.41) HSD11B1ALDH1A1L3MBTL1KDM4EHSD17B10
SCHEMBL29464347 0.82 HSD11B1 (0.39) HTTHSD11B1ALDH1A1L3MBTL1KDM4E

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-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN claimed
CN-109641873-B N- (pyridin-2-yl) pyridine-sulfonamide derivatives and their use for the treatment of disease 诺华股份有限公司 2022-03-18 CN disclosed