SCHEMBL5199563

SCHEMBL5199563

C[C@@H](O[C@@H]1CCN(C(=O)C2CCC(NC(=O)O)CC2)C[C@@H]1c1ccccc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.62

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
SCHEMBL6000471 1.00 TACR1 (0.62) TACR1
SCHEMBL5198160 1.00 TACR1 (0.62) TACR1
SCHEMBL5201189 1.00 TACR1 (0.62) TACR1
SCHEMBL5199560 1.00 TACR1 (0.62) TACR1
SCHEMBL5199391 1.00 TACR1 (0.62) TACR1
SCHEMBL5201179 1.00 TACR1 (0.62) TACR1
SCHEMBL5199388 1.00 TACR1 (0.62) TACR1
SCHEMBL5198157 1.00 TACR1 (0.62) TACR1
SCHEMBL5201176 1.00 TACR1 (0.62) TACR1
SCHEMBL5197477 0.94 TACR1 (0.64) TACR1

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-1790636-A1 PIPERIDINE DERIVATIVES AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2007-05-30 EP disclosed