SCHEMBL2472585

SCHEMBL2472585

O=C(NCC(O)c1cccc(F)c1)Oc1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nn1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 15/20 0.64
DCTPP1 Q9H773 2/20 0.50

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
SCHEMBL2467645 0.92 SCD (0.74) SCDDCTPP1
SCHEMBL2464958 0.92 SCD (0.74) SCDDCTPP1
SCHEMBL936795 0.87 SCD (0.84) SCDDCTPP1
SCHEMBL2469810 0.85 SCD (0.75) SCDDCTPP1
SCHEMBL2470913 0.84 SCD (0.62) SCDDCTPP1
SCHEMBL2462956 0.84 SCD (0.57) SCDDCTPP1
SCHEMBL2466890 0.83 SCD (0.57) SCDDCTPP1
SCHEMBL2465005 0.83 SCD (0.60) SCDDCTPP1
SCHEMBL2466025 0.81 SCD (0.55) SCDDCTPP1
SCHEMBL2470279 0.80 SCD (0.55) SCDDCTPP1

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-1648874-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2011-10-05 EP claimed