SCHEMBL9670554

SCHEMBL9670554

CCOCn1cnc2ccccc21

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.59
SMN1; SMN2 Q16637 7/20 0.58
LMNA P02545 6/20 0.58
CYP11B1 P15538 5/20 0.53
CYP11B2 P19099 5/20 0.53
TNF P01375 1/20 0.53
HTT P42858 5/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
TSHR P16473 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
MAPK1 P28482 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
PKM P14618 1/20 0.49
ALOX15 P16050 1/20 0.49
ALDH1A1 P00352 1/20 0.48
MAPT P10636 1/20 0.48
STAT3 P40763 1/20 0.48
APAF1 O14727 1/20 0.48

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
SCHEMBL3067924 0.89 TDP1 (0.68) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL1026457 0.83 SMN1; SMN2 (0.79) TDP1SMN1; SMN2LMNAHTTL3MBTL1
SCHEMBL2640498 0.82 TDP1 (0.63) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL28299452 0.82 SMN1; SMN2 (0.62) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL5388791 0.81 SMN1; SMN2 (0.85) TDP1SMN1; SMN2LMNAHTTL3MBTL1
SCHEMBL2357255 0.81 SMN1; SMN2 (0.56) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL30013328 0.81 SMN1; SMN2 (0.56) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL1623128 0.80 AGER (0.64) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL226221 0.80 TDP1 (0.70) TDP1SMN1; SMN2LMNACYP11B1CYP11B2
SCHEMBL9080800 0.79 EGLN3 (0.51) TDP1SMN1; SMN2LMNACYP11B1CYP11B2

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-0254322-B1 BENZIMIDAZOLE DERIVATIVES NISSHIN FLOUR MILLING CO., LTD. (JP) 1992-09-23 EP disclosed
US-4886803-A CARDIOTONIC AGENTS NISSHIN FLOUR MILLING CO., LTD. (JP) 1989-12-12 US disclosed
EP-0254322-A1 Benzimidazole derivatives NISSHIN FLOUR MILLING CO., LTD. (JP) 1988-01-27 EP disclosed