SCHEMBL7551669

SCHEMBL7551669

COC(=O)Nc1ccc(SCc2nc3ccccc3o2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 9/20 0.53
▸ ALDH1A1 P00352 6/20 0.53
▸ MAPT P10636 5/20 0.53
▸ LMNA P02545 1/20 0.53
▸ AGPAT2 O15120 1/20 0.51
▸ NPC1 O15118 6/20 0.46
▸ CLK1 P49759 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ MEN1 O00255 5/20 0.46
▸ KMT2A Q03164 5/20 0.46
▸ TSHR P16473 3/20 0.46
▸ SMN1; SMN2 Q16637 3/20 0.45
▸ POLB P06746 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ TP53 P04637 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ USP2 O75604 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
SCHEMBL7542952 0.80 SMN1; SMN2 (0.57) RAB9AALDH1A1MAPTLMNAAGPAT2
SCHEMBL7551697 0.74 ALOX5 (0.66) RAB9AALDH1A1MAPTLMNANPC1
SCHEMBL7545139 0.73 AGPAT2 (0.53) RAB9AMAPTLMNAAGPAT2NPC1
SCHEMBL7544713 0.73 AGPAT2 (0.60) MAPTAGPAT2KMT2APOLBTP53
SCHEMBL7544358 0.73 AGPAT2 (0.52) RAB9AALDH1A1MAPTLMNAAGPAT2
SCHEMBL11195754 0.71 NPC1 (0.70) RAB9AALDH1A1MAPTAGPAT2NPC1
SCHEMBL23906432 0.70 RAB9A (0.54) RAB9AALDH1A1MAPTLMNANPC1
SCHEMBL5624696 0.70 MAPT (0.54) RAB9AALDH1A1MAPTLMNANPC1
SCHEMBL7543727 0.70 AGPAT2 (0.48) RAB9AALDH1A1MAPTLMNAAGPAT2
SCHEMBL7547340 0.69 MEN1 (0.60) RAB9AALDH1A1MAPTLMNANPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0795550-B1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO CO (JP) 2002-06-05 — — EP disclosed
US-5736487-A HERBICIDES SANKYO COMPANY, LIMITED (JP) 1998-04-07 — — US disclosed
EP-0795550-A1 Aniline derivatives having herbicidal activity their preparation and their use SANKYO COMPANY LIMITED (JP) 1997-09-17 — — EP disclosed
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