SCHEMBL6948237

SCHEMBL6948237

CCOC(=O)c1cccc2nc(-c3ccccc3)[nH]c12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
PARP1 P09874 1/20 0.48
MAPK1 P28482 3/20 0.47
KDM4E B2RXH2 2/20 0.47
HSD17B10 Q99714 2/20 0.47
USP2 O75604 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ALDH1A1 P00352 5/20 0.47
SMN1; SMN2 Q16637 5/20 0.47
MAPT P10636 4/20 0.47
LMNA P02545 3/20 0.47
ATM Q13315 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GAA P10253 2/20 0.46
HPGD P15428 2/20 0.46

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
SCHEMBL6810427 0.90 PKN1 (0.58) TSHRPARP1MAPK1NPSR1PKN1
SCHEMBL5970052 0.88 TSHR (0.55) TSHRMAPK1KDM4EHSD17B10TDP1
SCHEMBL697780 0.85 KDM4E (0.54) PARP1KDM4ETDP1L3MBTL1ALDH1A1
SCHEMBL3580405 0.85 MMP2 (0.50) PARP1MAPK1L3MBTL1ALDH1A1SMN1; SMN2
SCHEMBL3574926 0.83 MAPT (0.55) MAPK1L3MBTL1ALDH1A1SMN1; SMN2MAPT
SCHEMBL10212480 0.83 KDM4E (0.55) PARP1KDM4ETDP1L3MBTL1ALDH1A1
SCHEMBL25433684 0.83 SCN1A (0.43) TSHRPARP1MAPK1KDM4EHSD17B10
SCHEMBL6170666 0.82 TSHR (0.53) TSHRPARP1KDM4EHSD17B10L3MBTL1
SCHEMBL5886053 0.82 TNKS (0.43) PARP1KDM4EALDH1A1SMN1; SMN2LMNA
SCHEMBL3575168 0.81 SIRT2 (0.52) PARP1HSD17B10TDP1ALDH1A1SMN1; SMN2

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