SCHEMBL10069269

SCHEMBL10069269

Clc1ccc(/C=C/C2CCNCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 4/20 0.51
HTR3A P46098 1/20 0.42
CYP1A2 P05177 1/20 0.41
AHR P35869 1/20 0.39
KHK P50053 1/20 0.39
USP2 O75604 1/20 0.38
KCNH2 Q12809 1/20 0.38
JAK2 O60674 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM1A O60341 1/20 0.36

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
SCHEMBL6011685 0.81 MAOB (0.51) MAOBCYP1A2KHKALDH1A1KDM1A
SCHEMBL6011041 0.81 MAOB (0.51) MAOBKHKALDH1A1MAPTSMN1; SMN2
SCHEMBL30683539 0.81 MAOB (0.51) MAOBKHKALDH1A1MAPTSMN1; SMN2
SCHEMBL5213208 0.81 MAOB (0.51) MAOBKHK
SCHEMBL6011027 0.81 TYR (0.42) MAOBCYP1A2KHKUSP2ALDH1A1
SCHEMBL27140897 0.81 KDM1A (0.51) MAOBKHKALDH1A1LMNAKDM1A
SCHEMBL20015683 0.81 KDM1A (0.51) MAOBKHKALDH1A1LMNAKDM1A
SCHEMBL818902 0.81 KDM1A (0.51) MAOBKHKALDH1A1LMNAKDM1A
SCHEMBL6002534 0.81 HTR3A (0.44) HTR3ACYP1A2
SCHEMBL28339223 0.81 MAOB (0.54) MAOBCYP1A2AHRJAK2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018055096-A1 DISUBTITUTED AZETIDINES, PYRROLIDINES, PIPERIDINES AND AZEPANES AS INHIBITORS OF MONOAMINE OXIDASE B FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES UNIVERSITY OF LJUBLJANA (SI) 2018-03-29 WO disclosed
EP-2476682-B1 8-OXODIHYDROPURINE DERIVATIVE SUMITOMO DAINIPPON PHARMA CO LTD (JP) 2017-04-26 EP disclosed
EP-1785415-B1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-05-02 EP disclosed
WO-2011030798-A1 8-OXODIHYDROPURINE DERIVATIVE 大日本住友製薬株式会社 (JP) 2011-03-17 WO disclosed
US-20080070898-A1 Piperidine Derivative or Pharmaceutically Acceptable Salt Thereof ASTELLAS PHARMA INC. (JP) 2008-03-20 US disclosed
US-20080070898-A1 Piperidine Derivative or Pharmaceutically Acceptable Salt Thereof ASTELLAS PHARMA INC. (JP) 2008-03-20 US disclosed
EP-1785415-A1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Astellas Pharma Inc. (JP) 2007-05-16 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-20080070898-A1 Piperidine Derivative or Pharmaceutically Acceptable Salt Thereof TRPV1, TRPA1, CACNA1D MAOB 3198/4885HTR3A 785/4885CYP1A2 2337/4885

“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.