SCHEMBL3315877

SCHEMBL3315877

NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 1.00
HSD17B10 Q99714 1/20 1.00
KMT2A Q03164 2/20 0.62
ALDH1A1 P00352 4/20 0.61
POLB P06746 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
GAA P10253 1/20 0.59
RAB9A P51151 2/20 0.58
GRM5 P41594 1/20 0.57
LMNA P02545 2/20 0.56
HPGD P15428 1/20 0.56
MAPT P10636 1/20 0.55
MGLL Q99685 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.54

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
SCHEMBL3315881 1.00 GLA (1.00) GLAHSD17B10KMT2AALDH1A1POLB
SCHEMBL2995058 0.88 GLA (0.79) GLAHSD17B10ALDH1A1GAARAB9A
SCHEMBL2995061 0.87 GLA (0.77) GLAHSD17B10ALDH1A1GAARAB9A
SCHEMBL3589877 0.86 GLA (0.75) GLAHSD17B10KMT2AALDH1A1L3MBTL1
SCHEMBL3315160 0.86 GLA (0.75) GLAHSD17B10KMT2AALDH1A1POLB
SCHEMBL3315157 0.86 GLA (0.75) GLAHSD17B10KMT2AALDH1A1POLB
SCHEMBL3589879 0.86 GLA (0.75) GLAHSD17B10KMT2AALDH1A1L3MBTL1
SCHEMBL3319140 0.85 HSD17B10 (0.74) GLAHSD17B10ALDH1A1POLBL3MBTL1
SCHEMBL3319143 0.85 HSD17B10 (0.74) GLAHSD17B10ALDH1A1POLBL3MBTL1
SCHEMBL5909045 0.84 GLA (0.72) GLAHSD17B10KMT2AALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150166481-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORPORATION (JP) 2015-06-18 US 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-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-8338142-B2 Method for producing optically active 3-aminopiperidine or salt thereof KANEKA CORPORATION (JP) 2012-12-25 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
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORPORATION (JP) 2010-04-29 US disclosed
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF KANEKA CORPORATION (JP) 2010-04-29 US 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 GLA 2225/4885HSD17B10 883/4885KMT2A 1778/4885
US-20100105917-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP GLA 2225/4885HSD17B10 883/4885KMT2A 1778/4885
US-20150166481-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE 3-AMINOPIPERIDINE OR SALT THEREOF NPEPPS, APEH, DNPEP GLA 2225/4885HSD17B10 883/4885KMT2A 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.