SCHEMBL6946463

SCHEMBL6946463

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
HSD17B10 Q99714 3/20 0.45
TSHR P16473 2/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
HTT P42858 3/20 0.44
MAPT P10636 2/20 0.44
LMNA P02545 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TP53 P04637 2/20 0.44
PRNP P04156 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
PSMD14 O00487 1/20 0.43
GAA P10253 1/20 0.43
MMP9 P14780 1/20 0.43
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
NPSR1 Q6W5P4 2/20 0.43

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
SCHEMBL6950725 0.82 CYP1A2 (0.51) KDM4EHSD17B10TSHRHTTMAPT
SCHEMBL6948259 0.77 TSHR (0.54) KDM4EHSD17B10TSHRMAPK1MEN1
SCHEMBL17380973 0.71 POLB (0.58) KDM4EHSD17B10TSHRMEN1KMT2A
SCHEMBL6510757 0.71 KDM4E (0.47) KDM4EHSD17B10TSHRMEN1KMT2A
SCHEMBL6510759 0.70 KDM4E (0.46) KDM4EHSD17B10TSHRMEN1KMT2A
SCHEMBL945578 0.70 POLB (0.61) MEN1KMT2AHTTMAPTLMNA
SCHEMBL8010526 0.69 MEN1 (0.50) MEN1KMT2AHTTMAPTLMNA
SCHEMBL10615359 0.69 KDM4E (0.60) KDM4EHSD17B10TSHRMEN1KMT2A
SCHEMBL7018296 0.69 RAB9A (0.58) KDM4EHSD17B10TSHRMEN1KMT2A
SCHEMBL11431402 0.69 POLB (0.52) KDM4EHSD17B10MAPK1MEN1KMT2A

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