SCHEMBL7821271

SCHEMBL7821271

COc1ccccc1C(=O)Nc1cccc(C(=O)O)c1

nearest known ligand 0.82

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNK3 O14649 7/20 0.82
KCNK9 Q9NPC2 7/20 0.82
MAPK1 P28482 1/20 0.71
KMT2A Q03164 3/20 0.69
POLB P06746 1/20 0.69
GRM5 P41594 1/20 0.69
MAPT P10636 2/20 0.67
RAB9A P51151 2/20 0.67
ALDH1A1 P00352 1/20 0.67
NPC1 O15118 1/20 0.66
MEN1 O00255 1/20 0.62

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
SCHEMBL11795078 0.89 KCNK3 (0.73) KCNK3KCNK9MAPK1KMT2APOLB
SCHEMBL31311158 0.86 KCNK3 (0.72) KCNK3KCNK9MAPK1KMT2AMAPT
SCHEMBL2362772 0.85 KMT2A (0.82) KCNK3KCNK9MAPK1KMT2APOLB
SCHEMBL28197272 0.85 NR1H4 (0.69) KCNK3KCNK9MAPK1KMT2ARAB9A
SCHEMBL1505333 0.84 RAB9A (0.60) KCNK3KCNK9MAPK1KMT2APOLB
SCHEMBL7179615 0.84 GRM5 (0.63) KCNK3KCNK9KMT2APOLBGRM5
SCHEMBL2912793 0.84 KCNK3 (0.62) KCNK3KCNK9MAPK1KMT2APOLB
SCHEMBL16676736 0.83 POLB (0.76) KCNK3KCNK9MAPK1KMT2APOLB
SCHEMBL28826743 0.83 KCNK3 (0.83) KCNK3KCNK9MAPK1KMT2APOLB
SCHEMBL19642749 0.83 KCNK3 (1.00) KCNK3KCNK9MAPK1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12310944-B2 Selective butyrylcholinesterase inhibitor or pharmaceutically acceptable salt thereof, preparation method and use thereof CHINA PHARMACEUTICAL UNIVERSITY (CN) 2025-05-27 US disclosed
US-20230165833-A1 Selective Butyrylcholinesterase Inhibitor or Pharmaceutically Acceptable Salt Thereof, Preparation Method and Use Thereof CHINA PHARMACEUTICAL UNIVERSITY (CN) 2023-06-01 US disclosed
WO-2021042410-A1 SELECTIVE BUTYRYLCHOLINESTERASE INHIBITOR OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 中国药科大学 2021-03-11 WO disclosed
CN-110627767-B Selective butyrylcholinesterase inhibitor or pharmaceutically acceptable salt thereof, preparation method and application thereof 中国药科大学 2020-08-25 CN disclosed
CN-110627767-A Selective butyrylcholinesterase inhibitor or pharmaceutically acceptable salt thereof, preparation method and application thereof 中国药科大学 2019-12-31 CN disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 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 (2 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-20230165833-A1 Selective Butyrylcholinesterase Inhibitor or Pharmaceutically Acceptable Salt Thereof, Preparation Method and Use Thereof BCHE, ACHE, BACE1 KCNK3 1980/4885KCNK9 545/4885MAPK1 1357/4885
US-12310944-B2 Selective butyrylcholinesterase inhibitor or pharmaceutically acceptable salt thereof, preparation method and use thereof BCHE, ACHE, BACE1 KCNK3 2135/4885KCNK9 679/4885MAPK1 1501/4885

“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.