SCHEMBL736419

SCHEMBL736419

O=C1OC2(CCNCC2)CN1c1ccc(F)cn1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 16/20 0.52
SSTR5 P35346 1/20 0.42
NPY5R Q15761 3/20 0.39

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
SCHEMBL735499 0.82 GRM5 (0.41) GRM5
SCHEMBL16430744 0.81 KCNJ1 (0.50) GRM5
SCHEMBL736968 0.80 NPY5R (0.49) SSTR5NPY5R
SCHEMBL738190 0.79 NPY5R (0.52) GRM5NPY5R
SCHEMBL737753 0.77 NPY5R (0.53) GRM5NPY5R
SCHEMBL736989 0.77 CDK4 (0.43) GRM5SSTR5NPY5R
SCHEMBL737427 0.76 GRM5 (0.48) GRM5NPY5R
SCHEMBL12066308 0.75 GRM5 (0.42) GRM5SSTR5NPY5R
SCHEMBL17723613 0.74 KCNJ1 (0.48) GRM5NPY5R
SCHEMBL16438881 0.74 KCNJ1 (0.49) GRM5NPY5R

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8138206-B2 Piperidine derivative MSD. K.K. (JP) 2012-03-20 US disclosed
US-20090137576-A1 Novel Piperidine Derivative MSD K.K. (JP) 2009-05-28 US disclosed
EP-1892241-A1 NOVEL PIPERIDINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2008-02-27 EP 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-20090137576-A1 Novel Piperidine Derivative HRH4, HRH3, HRH1 GRM5 263/4885SSTR5 1096/4885NPY5R 385/4885

“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.