SCHEMBL738629

SCHEMBL738629

NC[C]1CCN(c2ccc(OCc3ccccc3)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.54
MAPT P10636 5/20 0.49
RAB9A P51151 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
GAA P10253 1/20 0.49
MAOA P21397 1/20 0.49
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
HTT P42858 1/20 0.47
LTA4H P09960 2/20 0.47
CYP1A2 P05177 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGS2 P35354 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HIF1A Q16665 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
HRH3 Q9Y5N1 2/20 0.46

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
SCHEMBL10437652 0.84 HRH3 (0.58) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL735870 0.82 MAPT (0.52) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL16046663 0.82 LTA4H (0.62) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL9047395 0.80 LTA4H (0.60) RAB9ASMN1; SMN2LMNAALDH1A1HTT
SCHEMBL2342568 0.79 LMNA (0.51) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL738630 0.79 PRMT5 (0.56) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL13279833 0.79 GSTP1 (0.52) MAPTRAB9ASMN1; SMN2L3MBTL1LMNA
SCHEMBL7891469 0.79 MAPT (0.49) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL7891590 0.78 PRMT5 (0.55) MAOBMAPTRAB9ASMN1; SMN2L3MBTL1
SCHEMBL13202898 0.78 RAB9A (0.67) MAPTRAB9ALMNAALDH1A1HTT

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 MAOB 1314/4885MAPT 4377/4885RAB9A 2876/4885

“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.