SCHEMBL5199798

SCHEMBL5199798

CC(=O)N[C@H]1CC[C@H](C(=O)N2CC[C@H](O[C@H](C)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)[C@H](c3ccc(F)cc3)C2)CC1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 20/20 0.72
KCNH2 Q12809 1/20 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
SCHEMBL5199796 1.00 TACR1 (0.72) TACR1KCNH2
SCHEMBL5199792 1.00 TACR1 (0.72) TACR1KCNH2
SCHEMBL4946374 0.94 TACR1 (0.70) TACR1KCNH2
SCHEMBL4946379 0.94 TACR1 (0.70) TACR1KCNH2
SCHEMBL5199784 0.93 TACR1 (0.64) TACR1
SCHEMBL5197477 0.93 TACR1 (0.64) TACR1
SCHEMBL5197956 0.93 TACR1 (0.64) TACR1
SCHEMBL5197474 0.93 TACR1 (0.64) TACR1
SCHEMBL4941200 0.90 TACR1 (0.67) TACR1KCNH2
SCHEMBL4944034 0.90 TACR1 (0.67) TACR1KCNH2

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 2 patents. 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
US-20060142337-A1 Piperidine derivative and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-06-29 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060142337-A1 Piperidine derivative and use thereof AR, AHR, ARNT TACR1 364/4885KCNH2 524/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.