SCHEMBL4483740

SCHEMBL4483740

CC(C)(C)OC(=O)N1CC[C@H](OCc2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](c2ccc(F)cc2)C1

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.55

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
SCHEMBL4483735 1.00 TACR1 (0.55) TACR1
SCHEMBL4483731 1.00 TACR1 (0.55) TACR1
SCHEMBL5177843 0.93 TACR1 (0.57) TACR1
SCHEMBL4485766 0.92 TACR1 (0.65) TACR1
SCHEMBL4480800 0.92 TACR1 (0.65) TACR1
SCHEMBL4485768 0.92 TACR1 (0.65) TACR1
SCHEMBL5161511 0.91 TACR1 (0.51) TACR1
SCHEMBL5159340 0.88 TACR1 (0.53) TACR1
SCHEMBL5156796 0.86 TACR1 (0.54) TACR1
SCHEMBL4483548 0.85 TACR1 (0.57) 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
US-7622487-B2 Piperidine derivative, process for producing the same, and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-24 US disclosed