SCHEMBL2472609

SCHEMBL2472609

O=C(NCCOc1ccc(F)cc1)Oc1ccc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)nn1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 13/20 0.53
DCTPP1 Q9H773 2/20 0.53

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
SCHEMBL2470287 0.94 SCD (0.57) SCDDCTPP1
SCHEMBL2472501 0.93 SCD (0.57) SCDDCTPP1
SCHEMBL2469121 0.89 SCD (0.65) SCDDCTPP1
SCHEMBL2470074 0.87 SCD (0.66) SCDDCTPP1
SCHEMBL936659 0.87 SCD (0.70) SCDDCTPP1
SCHEMBL2468438 0.86 SCD (0.58) SCDDCTPP1
SCHEMBL2472808 0.85 SCD (0.58) SCDDCTPP1
SCHEMBL2466765 0.84 SCD (0.65) SCDDCTPP1
SCHEMBL2464956 0.84 SCD (0.58) SCDDCTPP1
SCHEMBL2467243 0.84 SCD (0.73) 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