SCHEMBL6674308

SCHEMBL6674308

OC(c1ccccc1)[C@H]1CCCN1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 7/20 0.55
SLC6A2 P23975 5/20 0.55
SLC6A4 P31645 4/20 0.55
HIF1A Q16665 1/20 0.54
HSD17B10 Q99714 1/20 0.54
DHFR P00374 1/20 0.51
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
TSHR P16473 1/20 0.50
TDP1 Q9NUW8 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
SCHEMBL20482096 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL13293156 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20440763 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL5177411 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL9872556 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20439223 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20482420 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
SCHEMBL20482130 1.00 SLC6A3 (0.55) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
Hydrochloric Acid SCHEMBL20482410 0.98 SLC6A3 (0.54) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10
Hydrochloric Acid SCHEMBL3552029 0.98 SLC6A3 (0.54) SLC6A3SLC6A2SLC6A4HIF1AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110831951-B Multiple coupling and oxidation process 罗氏创新中心哥本哈根有限公司 2023-10-27 CN disclosed
CN-109311925-B Enhanced coupling of sterically defined oxaazaphospholane phosphoramidite monomers to nucleosides or oligonucleotides 罗氏创新中心哥本哈根有限公司 2022-06-03 CN disclosed
CN-110831951-A Multiple coupling and oxidation process 罗氏创新中心哥本哈根有限公司 2020-02-21 CN disclosed
CN-110325512-A The method for being used to prepare chiral pyrrolidine -2- base carbinol derivatives 豪夫迈·罗氏有限公司 2019-10-11 CN disclosed
WO-2018153820-A1 PROCESS FOR THE PREPARATION OF CHIRAL PYROLLIDINE-2-YL- METHANOL DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2018-08-30 WO disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-7666888-B2 Substituted azole aromatic heterocycles as inhibitors of 11β-HSD-1 AMGEN INC. (US) 2010-02-23 US disclosed
US-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 AMGEN INC. 2008-01-24 US disclosed
US-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 AMGEN INC. 2008-01-24 US disclosed
EP-1478645-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS Amgen Inc. (US) 2004-11-24 EP disclosed
WO-2003066630-A2 QUINOLINONE DERIVATIVES FOR TREATING CELL PROLIFERATION RELATED DISORDERS AMGEN INC. (US) 2003-08-14 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 (1 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-20080021022-A1 SUBSTITUTED AZOLE AROMATIC HETEROCYCLES AS INHIBITORS OF 11BETA-HSD-1 HSD17B1, HSD11B1, HSD17B11 SLC6A3 2642/4885SLC6A2 3032/4885SLC6A4 1532/4885

“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.