SCHEMBL28269314

SCHEMBL28269314

Cc1cc(-c2cc(N)nc(S(C)(=O)=O)n2)n[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPC1 O15118 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ GAA P10253 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ ALK Q9UM73 1/20 0.36
▸ SMN1; SMN2 Q16637 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.36
▸ LMNA P02545 4/20 0.35
▸ AURKA O14965 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ SDHB P21912 5/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ PDE10A Q9Y233 1/20 0.34
▸ BPTF Q12830 1/20 0.33
▸ S1PR4 O95977 2/20 0.33
▸ TP53 P04637 2/20 0.33
▸ HPGD P15428 2/20 0.33

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
SCHEMBL28032854 0.80 HCAR2 (0.40) KDM4ESMN1; SMN2HCAR2LMNAKMT2A
SCHEMBL10519534 0.72 NOS3 (0.50) NPC1KDM4EHSD17B10GAAL3MBTL1
SCHEMBL28269313 0.72 NPC1 (0.38) NPC1KDM4EHSD17B10GAAL3MBTL1
SCHEMBL31135000 0.71 LOXL2 (0.36) NPC1KDM4EHSD17B10SMN1; SMN2RAB9A
SCHEMBL5022939 0.71 CCR1 (0.44) NPC1KDM4EHSD17B10L3MBTL1SMN1; SMN2
SCHEMBL5017672 0.70 BPTF (0.47) NPC1KDM4EHSD17B10SMN1; SMN2RAB9A
SCHEMBL21020091 0.68 KDM4E (0.67) NPC1KDM4EHSD17B10GAAL3MBTL1
SCHEMBL8597269 0.67 LMNA (0.42) NPC1KDM4EHSD17B10GAASMN1; SMN2
SCHEMBL5017675 0.67 LMNA (0.50) NPC1HSD17B10ALKRAB9ALMNA
SCHEMBL5022932 0.67 MAPT (0.65) NPC1KDM4EHSD17B10SMN1; SMN2RAB9A

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-104955459-B Substituted indoles -5- amphyl and its treatment use 南特知识产权控股有限责任公司 2019-02-01 — — CN disclosed
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