SCHEMBL8567716

SCHEMBL8567716

CCOC(=O)c1cccnc1NCCOC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.62
ALDH1A1 P00352 3/20 0.57
HSD17B10 Q99714 3/20 0.52
KDM4E B2RXH2 2/20 0.52
HPGD P15428 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
ATM Q13315 1/20 0.50
TSHR P16473 2/20 0.47
ADORA3 P0DMS8 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
PPIA P62937 1/20 0.47
PTGER4 P35408 1/20 0.46
MAPT P10636 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
MAPK1 P28482 1/20 0.45
CYP2C19 P33261 1/20 0.45
PKM P14618 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
SCHEMBL6612663 0.88 ALDH1A1 (0.68) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL6605329 0.85 HTT (0.60) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL28137220 0.85 HTT (0.65) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL4611494 0.83 HTT (0.64) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL2087895 0.83 HTT (0.57) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL2087007 0.83 HTT (0.57) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL1523101 0.83 HTT (0.57) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL1522683 0.82 MAPT (0.62) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL6587986 0.82 HTT (0.56) HTTALDH1A1HSD17B10KDM4EHPGD
SCHEMBL5763552 0.81 HTT (0.61) HTTALDH1A1HSD17B10KDM4EHPGD

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-0603001-B1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO CO (JP) 1998-08-26 EP disclosed
US-5459148-A Cardiovascular disorders SANKYO COMPANY, LIMITED (JP) 1995-10-17 US disclosed
EP-0603001-A1 Biphenyl derivatives, their preparation and their use for the treatment of hypertension and cardiac disease SANKYO COMPANY LIMITED (JP) 1994-06-22 EP disclosed