SCHEMBL3320822

SCHEMBL3320822

O=C(NC1CCCN(C(=O)c2ccccc2)C1)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.56
DRD4 P21917 1/20 0.56
GLA P06280 1/20 0.55
HSD17B10 Q99714 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CCR2 P41597 1/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
GRM5 P41594 2/20 0.54
MGLL Q99685 1/20 0.53
EPHX2 P34913 1/20 0.52
HSD11B1 P28845 1/20 0.52
CHRNA7 P36544 1/20 0.51
KDM5A P29375 1/20 0.51
USP30 Q70CQ3 1/20 0.50
RHOA P61586 1/20 0.50

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
SCHEMBL3320818 1.00 DRD2 (0.56) DRD2DRD4GLAHSD17B10L3MBTL1
SCHEMBL3316809 1.00 DRD2 (0.56) DRD2DRD4GLAHSD17B10L3MBTL1
SCHEMBL3316814 1.00 DRD2 (0.56) DRD2DRD4GLAHSD17B10L3MBTL1
SCHEMBL3320973 0.95 GLA (0.60) DRD2DRD4GLAHSD17B10L3MBTL1
SCHEMBL3317199 0.95 GLA (0.60) DRD2DRD4GLAHSD17B10L3MBTL1
SCHEMBL3316785 0.92 MEN1 (0.57) MEN1KMT2AEPHX2KDM5AUSP30
SCHEMBL3316788 0.92 MEN1 (0.57) MEN1KMT2AEPHX2KDM5AUSP30
SCHEMBL3316682 0.89 GRM5 (0.56) GLAHSD17B10CCR2KMT2AGRM5
SCHEMBL3316676 0.89 GRM5 (0.56) GLAHSD17B10CCR2KMT2AGRM5
SCHEMBL3316668 0.89 GRM5 (0.56) GLAHSD17B10CCR2KMT2AGRM5

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 DRD2 1223/4885DRD4 1032/4885GLA 2225/4885
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP DRD2 1223/4885DRD4 1032/4885GLA 2225/4885
US-20150166481-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP DRD2 1223/4885DRD4 1032/4885GLA 2225/4885

“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.