SCHEMBL7315170

SCHEMBL7315170

O=C1CCc2cc(C(=O)N3CCN(CC(O)c4ccccc4)CC3)ccc2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 4/20 0.53
KCNH2 Q12809 3/20 0.51
GRIN2B Q13224 2/20 0.51
NR3C1 P04150 1/20 0.49
PGR P06401 1/20 0.49
SLC6A4 P31645 1/20 0.49
PDE3B Q13370 1/20 0.49
PDE3A Q14432 1/20 0.49
GAA P10253 1/20 0.46
OGT O15294 4/20 0.46
KMT2A Q03164 3/20 0.46
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HTR1A P08908 1/20 0.44
DRD4 P21917 1/20 0.44
HTR2A P28223 1/20 0.44
HTR7 P34969 1/20 0.44
DRD3 P35462 1/20 0.44
ATM Q13315 1/20 0.43
MEN1 O00255 2/20 0.43

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
SCHEMBL7322154 0.89 KCNH2 (0.51) CRBNKCNH2GRIN2BNR3C1PGR
Hydrochloric Acid SCHEMBL7318449 0.89 CRBN (0.51) CRBNKCNH2GRIN2BNR3C1PGR
Hydrochloric Acid SCHEMBL7316762 0.88 KCNH2 (0.51) CRBNKCNH2GRIN2BNR3C1PGR
Hydrochloric Acid SCHEMBL7326137 0.88 HTR2A (0.50) CRBNKCNH2GRIN2BNR3C1PGR
Hydrochloric Acid SCHEMBL7287421 0.88 CRBN (0.52) CRBNKCNH2GRIN2BNR3C1PGR
SCHEMBL11045144 0.85 KCNH2 (0.55) CRBNKCNH2GRIN2BNR3C1PGR
SCHEMBL11071810 0.84 NR3C1 (0.56) CRBNKCNH2GRIN2BNR3C1PGR
SCHEMBL7294289 0.83 CRBN (0.51) CRBNKCNH2GRIN2BNR3C1PGR
Hydrochloric Acid SCHEMBL11040293 0.83 NR3C1 (0.55) CRBNKCNH2GRIN2BNR3C1PGR
SCHEMBL11040553 0.83 MEN1 (0.62) CRBNKCNH2GRIN2BNR3C1PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4845100-A WITH HYPOTENSIVE AND ANTIINFLAMMATORY ACTIVITY OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-07-04 US disclosed
EP-0202760-A2 Carbostyril derivatives and salts thereof, processes for preparing the same and cardiotonic composition containing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1986-11-26 EP disclosed