SCHEMBL8223804

SCHEMBL8223804

O[C@H](CN1CCCCC1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.69
MEN1 O00255 4/20 0.67
KMT2A Q03164 4/20 0.67
KDM4E B2RXH2 2/20 0.67
OPRM1 P35372 1/20 0.67
OPRD1 P41143 1/20 0.67
MAOB P27338 1/20 0.58
IGF1R P08069 3/20 0.56
ALDH1A1 P00352 2/20 0.54
HTT P42858 2/20 0.54
CYP2D6 P10635 1/20 0.54
TSHR P16473 1/20 0.54
HIF1A Q16665 1/20 0.54
MITF O75030 1/20 0.53
RAB9A P51151 1/20 0.53
GFER P55789 1/20 0.53
PAX8 Q06710 1/20 0.53
ATM Q13315 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53

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
SCHEMBL1460306 1.00 GAA (0.69) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL12573567 1.00 GAA (0.69) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL3082979 0.98 GAA (0.71) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL6979453 0.98 GAA (0.71) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL1205842 0.98 GAA (0.71) GAAMEN1KMT2AKDM4EOPRM1
Hydrochloric Acid SCHEMBL3089754 0.96 GAA (0.69) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL2796836 0.90 GAA (0.82) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL10746494 0.90 GAA (0.82) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL3976521 0.85 GAA (0.74) GAAMEN1KMT2AKDM4EOPRM1
SCHEMBL1460271 0.84 MEN1 (0.59) GAAMEN1KMT2AKDM4EOPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11130734-B2 Amino alcohol-boron-binol complex and method for preparing optically active amino alcohol derivative by using same MOLECULES & MATERIALS CO., LTD. (KR) 2021-09-28 US disclosed
US-11130734-B2 Amino alcohol-boron-binol complex and method for preparing optically active amino alcohol derivative by using same MOLECULES & MATERIALS CO., LTD. (KR) 2021-09-28 US disclosed
WO-2021141165-A1 AMINO ALCOHOL-BORON-BINOL COMPOSITE AND METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ALCOHOL DERIVATIVE USING SAME (주)분자와물질 2021-07-15 WO disclosed
US-20210206719-A1 AMINO ALCOHOL-BORON-BINOL COMPLEX AND METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ALCOHOL DERIVATIVE BY USING SAME MOLECULES & MATERIALS CO., LTD. (KR) 2021-07-08 US disclosed
US-20210206719-A1 AMINO ALCOHOL-BORON-BINOL COMPLEX AND METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ALCOHOL DERIVATIVE BY USING SAME MOLECULES & MATERIALS CO., LTD. (KR) 2021-07-08 US disclosed
CN-113072486-A Amino alcohol-boron-binaphthol complex and preparation method of optically active amino alcohol derivative using same 分子与物质株式会社 2021-07-06 CN disclosed
US-20100016374-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof GLAXO GROUP LIMITED (GB) 2010-01-21 US disclosed
US-20100016374-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof GLAXO GROUP LIMITED (GB) 2010-01-21 US disclosed
WO-2007113309-A2 COMPOUNDS WHICH INHIBIT THE GLYCINE TRANSPORTER AND USES THEREOF GLAXO GROUP LIMITED (GB) 2007-10-11 WO 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-11130734-B2 Amino alcohol-boron-binol complex and method for preparing optically active amino alcohol derivative by using same BCAT1, BCAT2, HBS1L GAA 4265/4885MEN1 924/4885KMT2A 3665/4885
US-20100016374-A1 Compounds Which Inhibit the Glycine Transporter and Uses Thereof SLC6A5, SLC6A9, SLC6A19 GAA 4171/4885MEN1 1559/4885KMT2A 3371/4885
US-20210206719-A1 AMINO ALCOHOL-BORON-BINOL COMPLEX AND METHOD FOR PREPARING OPTICALLY ACTIVE AMINO ALCOHOL DERIVATIVE BY USING SAME BCAT1, BCAT2, HBS1L GAA 4278/4885MEN1 1024/4885KMT2A 3481/4885

“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.