SCHEMBL7323865

SCHEMBL7323865

C=CCN(Cc1ccccc1)CC(O)COc1ccc2[nH]c(=O)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 2/20 0.44
ACHE P22303 1/20 0.44
MAOB P27338 1/20 0.44
KCNH2 Q12809 2/20 0.44
ALDH1A1 P00352 3/20 0.43
MAPT P10636 2/20 0.43
MAPK1 P28482 2/20 0.43
GAA P10253 1/20 0.43
CYP2D6 P10635 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.42
RXFP1 Q9HBX9 1/20 0.41
BCHE P06276 2/20 0.39
KDM1A O60341 1/20 0.39

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
SCHEMBL7329843 0.87 POLB (0.60) MEN1KMT2APOLBACHEMAOB
SCHEMBL7325519 0.85 MEN1 (0.62) MEN1KMT2APOLBACHEMAOB
SCHEMBL6651085 0.85 MEN1 (0.62) MEN1KMT2APOLBACHEMAOB
SCHEMBL7320830 0.85 MEN1 (0.62) MEN1KMT2APOLBACHEMAOB
SCHEMBL7330480 0.85 ALDH1A1 (0.52) MEN1KMT2APOLBACHEMAOB
SCHEMBL7325658 0.81 ALDH1A1 (0.51) MEN1KMT2APOLBACHEMAOB
SCHEMBL7354488 0.80 ACHE (0.47) MEN1KMT2APOLBACHEMAOB
SCHEMBL7330597 0.80 KCNH2 (0.49) MEN1KMT2APOLBACHEMAOB
SCHEMBL7330407 0.79 KCNH2 (0.43) MEN1KMT2APOLBACHEMAOB
SCHEMBL7330408 0.79 KCNH2 (0.43) MEN1KMT2APOLBACHEMAOB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5385914-A Cardiotonic carbostyril agents for treating heart ailments OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-01-31 US disclosed
EP-0355583-B1 Cardiotonics OTSUKA PHARMA CO LTD (JP) 1995-01-25 EP disclosed
US-5266577-A Method of treating congestive heart failure using carbostyril derivatives OTSUKA PHARMACEUTICAL COMPANY LTD. (JP) 1993-11-30 US disclosed
US-5198448-A Cardiovascular disorders OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1993-03-30 US disclosed
US-5053514-A Side effect reduction; carbostyril derivatives OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1991-10-01 US disclosed
EP-0355583-A2 Cardiotonics OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1990-02-28 EP disclosed