SCHEMBL8600133

SCHEMBL8600133

CCOC(=O)[C@H]1CC[C@H](C(=O)Nc2cc(OC)c(C#N)cc2C(=O)NCc2ccc(OC)c(Cl)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.44
KDM4E B2RXH2 2/20 0.44
PDE5A O76074 4/20 0.43
PDE11A Q9HCR9 1/20 0.43
POLB P06746 1/20 0.42
TSHR P16473 1/20 0.41
HPGD P15428 2/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TAS1R3 Q7RTX0 1/20 0.39
TAS1R1 Q7RTX1 1/20 0.39
WNT3A P56704 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
MAPT P10636 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL8600136 1.00 LMNA (0.44) LMNAKDM4EPDE5APDE11APOLB
SCHEMBL8299688 0.84 LMNA (0.44) LMNAKDM4EPDE11APOLBTSHR
SCHEMBL8299687 0.84 LMNA (0.44) LMNAKDM4EPDE11APOLBTSHR
SCHEMBL8603237 0.82 POLB (0.43) LMNAKDM4EPDE5APDE11APOLB
SCHEMBL8603233 0.82 POLB (0.43) LMNAKDM4EPDE5APDE11APOLB
SCHEMBL8602155 0.81 POLB (0.49) LMNAKDM4EPDE11APOLBHTT
SCHEMBL8602151 0.81 POLB (0.49) LMNAKDM4EPDE11APOLBHTT
SCHEMBL8292906 0.79 PDE5A (0.50) LMNAPDE5APDE11AHPGDGAA
SCHEMBL8293491 0.79 PDE5A (0.53) LMNAPDE5APDE11AHPGDGAA
SCHEMBL8292904 0.79 PDE5A (0.50) LMNAPDE5APDE11AHPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716993-A PHOSPHODIESTERASE ENZYME INHIBITOR FOR TREATING CARDIOVASCULAR DISORDER, ANGINA PECTORIS, HYPERTENSION, ASTHMA EISAI CO., LTD. (JP) 1998-02-10 US disclosed