SCHEMBL5199128

SCHEMBL5199128

C[C@@H](O[C@H]1CCN(C(=O)[C@H]2CC[C@H](N(C)C(=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
SCHEMBL5199780 0.94 TACR1 (0.64) TACR1
SCHEMBL5199778 0.94 TACR1 (0.64) TACR1
SCHEMBL5200273 0.93 TACR1 (0.59) TACR1
SCHEMBL5200278 0.93 TACR1 (0.59) TACR1
SCHEMBL5198044 0.91 TACR1 (0.63) TACR1
SCHEMBL5198053 0.91 TACR1 (0.63) TACR1
SCHEMBL5199745 0.91 TACR1 (0.67) TACR1
SCHEMBL5199741 0.91 TACR1 (0.67) TACR1
SCHEMBL5197932 0.90 TACR1 (0.64) TACR1
SCHEMBL5199447 0.90 TACR1 (0.66) 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