SCHEMBL3314080

SCHEMBL3314080

Cc1ccc(C(=O)N2CCCC(N)C2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.54
PKM P14618 1/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
KDM1A O60341 4/20 0.53
CA12 O43570 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
CA7 P43166 1/20 0.52
CA9 Q16790 1/20 0.52
CA14 Q9ULX7 1/20 0.52
RECQL P46063 1/20 0.51
GLA P06280 1/20 0.51
HSD17B10 Q99714 1/20 0.51
PROKR1 Q8TCW9 4/20 0.51
HPGD P15428 1/20 0.50
PADI4 Q9UM07 1/20 0.49
CRHBP P24387 1/20 0.49
CRHR2 Q13324 1/20 0.49
EPHX2 P34913 1/20 0.48

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
SCHEMBL3314069 1.00 ALDH1A1 (0.54) ALDH1A1PKMKMT2AMEN1KDM1A
SCHEMBL13398520 0.91 KDM1A (0.61) ALDH1A1PKMKMT2AMEN1KDM1A
SCHEMBL5692174 0.91 KDM1A (0.61) ALDH1A1PKMKMT2AMEN1KDM1A
SCHEMBL3314252 0.85 GLA (0.70) ALDH1A1KMT2AGLAHSD17B10PROKR1
SCHEMBL3314246 0.85 GLA (0.70) ALDH1A1KMT2AGLAHSD17B10PROKR1
SCHEMBL3314769 0.84 HPGD (0.59) ALDH1A1RECQLGLAHSD17B10HPGD
SCHEMBL3314775 0.84 HPGD (0.59) ALDH1A1RECQLGLAHSD17B10HPGD
SCHEMBL27970474 0.84 HPGD (0.59) ALDH1A1RECQLGLAHSD17B10HPGD
SCHEMBL17888327 0.84 PKM (0.59) ALDH1A1PKMKMT2AMEN1KDM1A
SCHEMBL3456176 0.83 RECQL (0.73) ALDH1A1PKMKMT2AMEN1CA12

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 ALDH1A1 1293/4885PKM 2522/4885KMT2A 1778/4885
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP ALDH1A1 1293/4885PKM 2522/4885KMT2A 1778/4885
US-20150166481-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP ALDH1A1 1293/4885PKM 2522/4885KMT2A 1778/4885

“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.