SCHEMBL22368459

SCHEMBL22368459

CC12CC1(CN)c1ccccc1O2

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.41
SLC6A4 P31645 1/20 0.31

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
SCHEMBL17974169 0.83 HTT (0.32) HTR2A
SCHEMBL17974167 0.73 TP53 (0.37)
SCHEMBL17959934 0.71 SLC6A4 (0.40) SLC6A4
SCHEMBL4714505 0.70 AKR1B1 (0.44) HTR2ASLC6A4
SCHEMBL22368460 0.70 POLB (0.35)
SCHEMBL22368461 0.68 AKR1B1 (0.35)
SCHEMBL4667749 0.66 HTR2A (0.53) HTR2A
SCHEMBL8343455 0.66 BACE1 (0.36) HTR2A
SCHEMBL10754629 0.65 HTR2A (0.34) HTR2A
SCHEMBL5677891 0.65 HTR2A (0.42) HTR2A

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
EP-3253755-B1 NOVEL CYCLOPROPABENZOFURANYL PYRIDOPYRAZINEDIONES PFIZER (US) 2020-08-26 EP disclosed