SCHEMBL7700449

SCHEMBL7700449

COc1ccc(N2Cc3ccc(CN4Cc5cnccc5C4=O)cc3C2=O)cc1OC1CCCC1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 14/20 0.43
PDE4A P27815 13/20 0.43
PDE4B Q07343 12/20 0.43
PDE4C Q08493 11/20 0.43
HTR2C P28335 3/20 0.41
HTR2A P28223 1/20 0.41

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
SCHEMBL7698109 0.88 PDE4D (0.46) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7700756 0.88 LMNA (0.47) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7692634 0.87 PDE4B (0.45) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL8713389 0.87 HTR2C (0.47) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7693683 0.86 PDE4A (0.45) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7701694 0.86 PDE4A (0.44) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7699545 0.86 HTR2C (0.42) PDE4DPDE4APDE4BPDE4CHTR2C
Hydrochloric Acid SCHEMBL8710356 0.86 HTR2C (0.46) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7700521 0.85 PDE4A (0.42) PDE4DPDE4APDE4BPDE4CHTR2C
SCHEMBL7701516 0.81 MCHR1 (0.42) PDE4DPDE4APDE4BPDE4CHTR2C

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
WO-2002081446-A1 3-CYCLOPENTYLOXY-4-METHOXYPHENYL-ISOINDOLINONE DERIVATIVES AND THE USE THEREOF DAEWOONG CO., LTD. (KR) 2002-10-17 WO disclosed