SCHEMBL18796708

SCHEMBL18796708

COC(=O)c1cc(Cc2ccc(F)cc2)c(=O)n2c1CCC2

nearest known ligand 0.80

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 8/20 0.80
PDE3A Q14432 8/20 0.80
ALDH1A1 P00352 2/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HSP90AA1 P07900 2/20 0.39
ATM Q13315 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
MAPT P10636 1/20 0.38
HSP90B1 P14625 1/20 0.38
KCNK3 O14649 1/20 0.37
P2RX7 Q99572 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
SCHEMBL18796783 0.98 PDE3B (0.77) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2
SCHEMBL18819702 0.90 PDE3B (0.69) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2
SCHEMBL16140688 0.89 PDE3B (1.00) PDE3BPDE3AALDH1A1HPGDNPSR1
SCHEMBL18796725 0.89 PDE3B (0.80) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2
SCHEMBL18796764 0.89 PDE3B (0.80) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2
SCHEMBL17480161 0.89 PDE3B (0.80) PDE3BPDE3AALDH1A1HPGDNPSR1
SCHEMBL18796755 0.88 PDE3B (0.81) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2
SCHEMBL18796705 0.88 PDE3B (0.74) PDE3BPDE3AALDH1A1MEN1KMT2A
SCHEMBL18796759 0.87 PDE3B (0.77) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2
SCHEMBL18796677 0.87 PDE3B (0.65) PDE3BPDE3AALDH1A1HPGDSMN1; SMN2

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
WO-2017072796-A1 2-PYRIDONE BASED COMPOUNDS USEFUL AS POTENTIAL PHOSPHODIESTERASE3A (PDE3A)INHIBITORS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-05-04 WO claimed
WO-2017072796-A1 2-PYRIDONE BASED COMPOUNDS USEFUL AS POTENTIAL PHOSPHODIESTERASE3A (PDE3A)INHIBITORS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-05-04 WO disclosed
WO-2017072796-A1 2-PYRIDONE BASED COMPOUNDS USEFUL AS POTENTIAL PHOSPHODIESTERASE3A (PDE3A)INHIBITORS AND A PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2017-05-04 WO disclosed