SCHEMBL6011748

SCHEMBL6011748

O=C(CN1CCOCC1)N1CCC(/C=C/c2ccc(F)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.50
MAOA P21397 2/20 0.50
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MAPT P10636 3/20 0.46
ALDH1A1 P00352 3/20 0.46
KMT2A Q03164 3/20 0.46
ATM Q13315 1/20 0.46
KDM4E B2RXH2 1/20 0.44
FKBP1A P62942 1/20 0.43
NAMPT P43490 1/20 0.42
NPC1 O15118 1/20 0.42
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL14261828 1.00 MAOB (0.50) MAOBMAOAALOX15TSHRHSD17B10
SCHEMBL6011036 0.91 ALOX15 (0.50) MAOBALOX15TSHRHSD17B10ALDH1A1
SCHEMBL6012010 0.88 TSHR (0.48) MAOBALOX15TSHRHSD17B10MAPT
SCHEMBL14261815 0.88 MAOB (0.50) MAOBALOX15TSHRHSD17B10MAPT
SCHEMBL6011774 0.88 ALDH1A1 (0.53) MAOBMAOAALOX15TSHRHSD17B10
SCHEMBL6011051 0.88 ALOX15 (0.48) MAOBALOX15TSHRHSD17B10ALDH1A1
SCHEMBL2718661 0.88 MAOB (0.50) MAOBMAOAALOX15TSHRHSD17B10
SCHEMBL2718666 0.88 MAOB (0.50) MAOBMAOAALOX15TSHRHSD17B10
SCHEMBL6012034 0.88 MAOB (0.50) MAOBMAOAALOX15TSHRHSD17B10
SCHEMBL10069198 0.88 TSHR (0.50) MAOBMAOAALOX15TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1785415-B1 PIPERIDINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF ASTELLAS PHARMA INC (JP) 2012-05-02 EP 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 3198/4885MAOA 3281/4885ALOX15 1198/4885

“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.