SCHEMBL7330407

SCHEMBL7330407

CCN(C/C=C/c1ccccc1)CC(O)COc1ccc2[nH]c(=O)ccc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.43
POLB P06746 1/20 0.41
NPY1R P25929 1/20 0.40
NPY2R P49146 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ABCB1 P08183 4/20 0.39
MAPT P10636 3/20 0.39
KDM1A O60341 1/20 0.39
TSHR P16473 2/20 0.37
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 2/20 0.37
PDE3B Q13370 2/20 0.37
PDE3A Q14432 2/20 0.37
KDM4E B2RXH2 1/20 0.37
PDE5A O76074 1/20 0.37
CYP3A4 P08684 1/20 0.37
HPGD P15428 1/20 0.37
PTAFR P25105 1/20 0.37

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
SCHEMBL7330408 1.00 KCNH2 (0.43) KCNH2POLBNPY1RNPY2RMEN1
SCHEMBL7329843 0.85 POLB (0.60) KCNH2POLBNPY1RNPY2RMEN1
SCHEMBL7325658 0.84 ALDH1A1 (0.51) KCNH2POLBNPY1RNPY2RMEN1
SCHEMBL7329615 0.83 POLB (0.47) KCNH2POLBNPY1RNPY2RMEN1
SCHEMBL7332778 0.81 KCNH2 (0.47) KCNH2POLBMEN1KMT2AMAPT
SCHEMBL7330480 0.79 ALDH1A1 (0.52) KCNH2POLBMEN1KMT2AMAPT
SCHEMBL7323865 0.79 MEN1 (0.46) KCNH2POLBMEN1KMT2AMAPT
SCHEMBL7323663 0.78 KCNH2 (0.48) KCNH2POLBMEN1KMT2AMAPT
SCHEMBL7330011 0.78 KDM4E (0.46) KCNH2MEN1KMT2AABCB1KDM1A
SCHEMBL7324308 0.78 KCNH2 (0.45) KCNH2POLBMEN1KMT2AABCB1

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