SCHEMBL6011007

SCHEMBL6011007

C(=C/C1CCNCC1)\c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 5/20 0.46
SLC6A2 P23975 5/20 0.46
SLC6A4 P31645 5/20 0.46
SLC6A3 Q01959 5/20 0.46
HRH1 P35367 1/20 0.46
LTA4H P09960 1/20 0.45
SRD5A2 P31213 1/20 0.44
MEN1 O00255 1/20 0.44
NPC1 O15118 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
RAB9A P51151 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TLR4 O00206 1/20 0.44
TLR2 O60603 1/20 0.44
KHK P50053 1/20 0.44
KDM1A O60341 1/20 0.42
GABRA1 P14867 1/20 0.41
GABRG2 P18507 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
SCHEMBL27140897 0.86 KDM1A (0.51) ALDH1A1LMNAKHKKDM1A
SCHEMBL818902 0.86 KDM1A (0.51) ALDH1A1LMNAKHKKDM1A
SCHEMBL20015683 0.86 KDM1A (0.51) ALDH1A1LMNAKHKKDM1A
Hydrochloric Acid SCHEMBL7469111 0.84 KDM1A (0.50) ALDH1A1LMNAKHKKDM1A
Hydrochloric Acid SCHEMBL7469122 0.84 KDM1A (0.50) ALDH1A1LMNAKHKKDM1A
Hydrochloric Acid SCHEMBL27154699 0.84 KDM1A (0.50) ALDH1A1LMNAKHKKDM1A
SCHEMBL6011015 0.83 KHK (0.45) HRH1ALDH1A1LMNAKHKKDM1A
SCHEMBL6009169 0.82 MAOB (0.55) NPC1ALDH1A1LMNARAB9AKDM1A
SCHEMBL9562264 0.82 MAOB (0.55) NPC1ALDH1A1LMNARAB9AKDM1A
SCHEMBL1348490 0.82 AKT1 (0.45) HTR1ASLC6A2SLC6A4SLC6A3HRH1

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 HTR1A 718/4885SLC6A2 246/4885SLC6A4 201/4885

“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.