SCHEMBL3316718

SCHEMBL3316718

CC(C)(C)OC(=O)N1CCCC(C(=O)OC(=O)C2CCCNC2)C1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
KMT2A Q03164 2/20 0.52
ALDH1A1 P00352 2/20 0.52
MEN1 O00255 1/20 0.52
HPGD P15428 1/20 0.47
EPHX1 P07099 1/20 0.40
SLC6A1 P30531 2/20 0.38
SLC6A11 P48066 1/20 0.38
TSHR P16473 1/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
SLC6A13 Q9NSD5 1/20 0.38
HSD11B1 P28845 1/20 0.38
ABL1 P00519 1/20 0.37
RIN1 Q13671 1/20 0.37
RECQL P46063 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ATM Q13315 1/20 0.37
CYP2D6 P10635 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL3316713 0.88 ALDH1A1 (0.63) MAPTKMT2AALDH1A1MEN1HPGD
Nipecotic Acid SCHEMBL8994034 0.86 MAPT (0.53) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL27782704 0.80 ALDH1A1 (0.45) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL9882415 0.79 ALDH1A1 (0.61) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL641371 0.79 ALDH1A1 (0.61) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL641372 0.79 ALDH1A1 (0.61) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL28917196 0.78 HPGD (0.43) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL160676 0.78 SLC6A1 (0.55) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL25700006 0.78 SLC6A1 (0.55) MAPTKMT2AALDH1A1MEN1HPGD
SCHEMBL160677 0.78 SLC6A1 (0.55) MAPTKMT2AALDH1A1MEN1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2123769-B1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORP (JP) 2016-05-18 EP disclosed
US-20150166481-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORPORATION (JP) 2015-06-18 US disclosed
US-20130079525-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORPORATION (JP) 2013-03-28 US disclosed
US-8338142-B2 Method for producing optically active 3-aminopiperidine or salt thereof KANEKA CORPORATION (JP) 2012-12-25 US disclosed
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORPORATION (JP) 2010-04-29 US disclosed
EP-2123769-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF Kaneka Corporation (JP) 2009-11-25 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 (3 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-20130079525-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP MAPT 4470/4885KMT2A 1778/4885ALDH1A1 1293/4885
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP MAPT 4470/4885KMT2A 1778/4885ALDH1A1 1293/4885
US-20150166481-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP MAPT 4470/4885KMT2A 1778/4885ALDH1A1 1293/4885

“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.