SCHEMBL6948259

SCHEMBL6948259

CCOC(=O)CC(=O)n1c(Cc2ccccc2)nc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
HTT P42858 3/20 0.53
PSMD14 O00487 1/20 0.50
GAA P10253 1/20 0.50
MMP9 P14780 1/20 0.47
MAOA P21397 1/20 0.47
MAOB P27338 1/20 0.47
KDM4E B2RXH2 2/20 0.46
HSD17B10 Q99714 2/20 0.46
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
MAPT P10636 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
LMNA P02545 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
PRNP P04156 1/20 0.45

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
SCHEMBL6946445 0.83 TSHR (0.62) TSHRMAPK1HTTGAAKDM4E
SCHEMBL6953023 0.81 CYP1A2 (0.53) TSHRHTTPSMD14GAAKDM4E
SCHEMBL221728 0.81 TSHR (0.60) TSHRMAPK1HTTGAAMMP9
SCHEMBL6946463 0.77 KDM4E (0.45) TSHRMAPK1HTTPSMD14GAA
SCHEMBL17380973 0.73 POLB (0.58) TSHRHTTKDM4EHSD17B10RAB9A
SCHEMBL15643536 0.73 MAPT (0.65) HTTKDM4EHSD17B10NPC1MAPT
SCHEMBL945578 0.71 POLB (0.61) HTTMAPTMEN1KMT2ALMNA
SCHEMBL10615359 0.71 KDM4E (0.60) TSHRHTTMMP9MAOAMAOB
SCHEMBL7018296 0.70 RAB9A (0.58) TSHRHTTPSMD14GAAKDM4E
SCHEMBL14499768 0.70 GAA (0.57) TSHRHTTPSMD14GAAKDM4E

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-0936218-B1 BENZIMIDAZOLE DERIVATIVES MOCHIDA PHARM CO LTD (JP) 2003-04-02 EP disclosed
US-6387938-B1 Benzimidazole derivatives MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2002-05-14 US disclosed
EP-0936218-A1 NOVEL BENZIMIDAZOLE DERIVATIVES MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 1999-08-18 EP disclosed