SCHEMBL738524

SCHEMBL738524

CCC(CC)N1CC2(CCN(c3ccc(O)cc3)CC2)OCC1=O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.38
KDM4E B2RXH2 3/20 0.38
LMNA P02545 2/20 0.38
GAA P10253 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR7 P34969 5/20 0.38
SIGMAR1 Q99720 5/20 0.37
OPRM1 P35372 3/20 0.37
PKM P14618 1/20 0.36
FASN P49327 2/20 0.36
KMT2A Q03164 1/20 0.32
OPRD1 P41143 1/20 0.31

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
SCHEMBL736683 0.87 MAPT (0.44) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL737027 0.82 SIGMAR1 (0.42) MAPTKDM4ELMNAALDH1A1HTT
SCHEMBL735292 0.82 FASN (0.44) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL735677 0.80 SIGMAR1 (0.52) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL737224 0.80 SIGMAR1 (0.40) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL738435 0.76 FASN (0.53) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL735357 0.75 SIGMAR1 (0.61) LMNAGAAALDH1A1SIGMAR1OPRM1
SCHEMBL737729 0.74 ME3 (0.37) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL736591 0.74 SIGMAR1 (0.48) MAPTKDM4ELMNAGAAALDH1A1
SCHEMBL736050 0.74 HRH3 (0.47)

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 MAPT 4377/4885KDM4E 1039/4885LMNA 4494/4885

“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.