SCHEMBL1600619

SCHEMBL1600619

O=C(NCCCc1ccc(F)cc1)c1cnc(N2CCN(C(=O)c3ccccc3C(F)(F)F)CC2)cn1

nearest known ligand 0.68

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
SCD O00767 16/20 0.68
DCTPP1 Q9H773 2/20 0.61

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
SCHEMBL1386336 0.95 SCD (0.69) SCDDCTPP1
SCHEMBL1383922 0.94 SCD (0.77) SCDDCTPP1
SCHEMBL1385282 0.89 SCD (0.77) SCDDCTPP1
SCHEMBL1599652 0.88 SCD (0.80) SCDDCTPP1
SCHEMBL937537 0.87 SCD (0.89) SCDDCTPP1
SCHEMBL1384433 0.86 SCD (0.76) SCDDCTPP1
SCHEMBL2468894 0.86 SCD (0.57) SCDDCTPP1
SCHEMBL1599640 0.83 SCD (0.88) SCDDCTPP1
SCHEMBL1385471 0.83 SCD (0.78) SCDDCTPP1
SCHEMBL1385398 0.82 SCD (0.60) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1651620-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2011-11-09 EP claimed
EP-1846035-B1 COMBINATION THERAPY XENON PHARMACEUTICALS INC (CA) 2011-09-21 EP claimed
EP-1651620-B1 PIPERAZINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS XENON PHARMACEUTICALS INC (CA) 2011-11-09 EP disclosed
US-8030488-B2 Piperazine derivatives as stearoyl-coa desaturase inhibitors and their use as therapeutic agents XENON PHARMACEUTICALS INC. (CA) 2011-10-04 US disclosed
EP-1846035-B1 COMBINATION THERAPY XENON PHARMACEUTICALS INC (CA) 2011-09-21 EP disclosed
EP-2316828-A1 Piperazine derivatives and their use as therapeutic agents Xenon Pharmaceuticals Inc. (CA) 2011-05-04 EP disclosed
US-7919484-B2 Combination therapy XENON PHARMACEUTICALS INC. (CA) 2011-04-05 US disclosed