SCHEMBL13763085

SCHEMBL13763085

Cc1c(O)cc2c(c1C)OC1(CCC1)CC2C1CO1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.32
PDPK1 O15530 1/20 0.32
PHLPP1 O60346 1/20 0.32
ILK Q13418 1/20 0.32

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
SCHEMBL4463143 0.83 AKT1 (0.34) AKT1PDPK1PHLPP1ILK
SCHEMBL4467672 0.77 AKT1 (0.36) AKT1PDPK1PHLPP1ILK
SCHEMBL13762914 0.77 PTGS1 (0.31)
SCHEMBL5340220 0.76 AKT1 (0.32) AKT1PDPK1PHLPP1ILK
SCHEMBL5315842 0.74 AKT1 (0.33) AKT1PDPK1PHLPP1ILK
SCHEMBL5314320 0.74 AKT1 (0.33) AKT1PDPK1PHLPP1ILK
SCHEMBL5316401 0.74 AKT1 (0.33) AKT1PDPK1PHLPP1ILK
SCHEMBL4476260 0.74 AKT1 (0.33) AKT1PDPK1PHLPP1ILK
SCHEMBL4469852 0.72 AKT1 (0.34) AKT1PDPK1PHLPP1ILK
SCHEMBL13763023 0.70

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-7576094-B2 Spiro derivatives as lipoxygenase inhibitors ELI LILLY AND COMPANY (US) 2009-08-18 US disclosed