SCHEMBL8707693

SCHEMBL8707693

CCOC(=O)C1CCC(C)CC1C(=O)Cc1c(C)cc(C)cc1C

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA1 P00915 10/20 0.37
CA2 P00918 10/20 0.37
CA9 Q16790 8/20 0.37
CA12 O43570 7/20 0.37
TRPM8 Q7Z2W7 1/20 0.36
POLB P06746 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33

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
SCHEMBL8708097 0.96 CA1 (0.37) CA1CA2CA9CA12TRPM8
SCHEMBL8704002 0.93 CA1 (0.37) CA1CA2CA9CA12POLB
SCHEMBL8703906 0.91 POLB (0.39) CA1CA2CA9CA12POLB
SCHEMBL8710228 0.88 KDM4E (0.33) TRPM8POLBKDM4EMAPT
SCHEMBL8710408 0.88 KDM4E (0.42) CA1CA2CA9CA12POLB
SCHEMBL8704301 0.86 POLB (0.37) CA1CA2CA9CA12POLB
SCHEMBL8022828 0.85 TP53 (0.39) POLBKDM4E
SCHEMBL8708085 0.85 POLB (0.40) CA1CA2CA9CA12POLB
SCHEMBL8709035 0.85 CA1 (0.37) CA1CA2CA9CA12POLB
SCHEMBL8708942 0.84 KCNQ3 (0.34) TRPM8POLBKDM4EMAPT

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-5808135-A HERBICIDE; PESTICIDE BAYER AKTIENGESELLSCHAFT (DE) 1998-09-15 US disclosed