SCHEMBL735835

SCHEMBL735835

O=C1OC2(CCNCC2)CN1c1ccccc1F

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 10/20 0.47
KCNH2 Q12809 2/20 0.47
ADRA1A P35348 1/20 0.47
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TRPV4 Q9HBA0 2/20 0.42
HTR6 P50406 1/20 0.41
OPRM1 P35372 3/20 0.40
OPRL1 P41146 1/20 0.40
SIGMAR1 Q99720 2/20 0.39
GRM2 Q14416 1/20 0.38

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
SCHEMBL18735596 0.85 MEN1 (0.42) NPY5RKCNH2ADRA1AMEN1KMT2A
SCHEMBL17319026 0.82 MEN1 (0.39) NPY5RKCNH2ADRA1AMEN1KMT2A
SCHEMBL11371921 0.82 OPRM1 (0.41) NPY5RKCNH2ADRA1AMEN1KMT2A
SCHEMBL737428 0.81 MEN1 (0.46) NPY5RKCNH2ADRA1AMEN1KMT2A
SCHEMBL3741390 0.81 NPY5R (0.52) NPY5RKCNH2ADRA1ATRPV4OPRM1
SCHEMBL3741394 0.81 NPY5R (0.52) NPY5RKCNH2ADRA1ATRPV4OPRM1
SCHEMBL13045576 0.81 NPY5R (0.52) NPY5RKCNH2ADRA1ATRPV4OPRM1
SCHEMBL736644 0.80 DRD2 (0.50) ADRA1AMEN1KMT2ATRPV4HTR6
SCHEMBL737322 0.80 OPRM1 (0.58) NPY5RKCNH2ADRA1AOPRM1SIGMAR1
SCHEMBL13045575 0.79 NPY5R (0.48) NPY5RKCNH2ADRA1AMEN1KMT2A

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 5 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
WO-2009037542-A2 SPIROCYCLIC COMPOUNDS AS STEAROYL COA DESATURASE INHIBITORS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-03-26 WO disclosed
WO-2009037542-A2 SPIROCYCLIC COMPOUNDS AS STEAROYL COA DESATURASE INHIBITORS GLENMARK PHARMACEUTICALS, S.A. (US) 2009-03-26 WO 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 NPY5R 385/4885KCNH2 308/4885ADRA1A 103/4885

“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.