SCHEMBL9882143

SCHEMBL9882143

C[C@@H](CCCNC(=S)Nc1ccc2c(c1)C(=O)OC21c2ccc(O)cc2Oc2cc(O)ccc21)C(=O)O

nearest known ligand 0.66

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 8/20 0.66
FTO Q9C0B1 5/20 0.60
NR1H2 P55055 1/20 0.54
TTR P02766 1/20 0.53
FOLH1 Q04609 2/20 0.52
JAK2 O60674 1/20 0.52
NQO1 P15559 1/20 0.51
KEAP1 Q14145 1/20 0.51
MAP1LC3B Q9GZQ8 1/20 0.51

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
SCHEMBL22863319 0.86 NAALAD2 (0.63) NAALAD2FTONR1H2TTRJAK2
SCHEMBL15744221 0.86 FTO (0.64) NAALAD2FTONR1H2TTRJAK2
SCHEMBL20729848 0.86 FTO (0.66) NAALAD2FTONR1H2TTRJAK2
SCHEMBL17956697 0.86 FTO (0.69) NAALAD2FTONR1H2TTRJAK2
SCHEMBL22314141 0.85 FTO (0.63) NAALAD2FTONR1H2TTRJAK2
SCHEMBL8893358 0.85 NAALAD2 (0.62) NAALAD2FTONR1H2TTRFOLH1
SCHEMBL29353892 0.85 FTO (0.63) NAALAD2FTONR1H2TTRFOLH1
SCHEMBL991216 0.85 FTO (0.63) NAALAD2FTONR1H2TTRFOLH1
SCHEMBL12754623 0.85 FTO (0.65) NAALAD2FTONR1H2TTRJAK2
SCHEMBL9293647 0.85 FTO (0.64) NAALAD2FTOTTRJAK2NQO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE49351-E1 Cytoprotective agent BIOGEN MA INC. (US) 2023-01-03 US disclosed
US-RE47684-E1 Cytoprotective agent TMS CO., LTD. (JP) 2019-11-05 US disclosed
US-9078880-B2 Cytoprotective agent NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2015-07-14 US disclosed
US-20120135996-A1 CYTOPROTECTIVE AGENT CORXEL PHARMACEUTICALS HONG KONG LIMITED (CN) 2012-05-31 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 (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-20120135996-A1 CYTOPROTECTIVE AGENT TXN2, TXNRD2, AIFM1 NAALAD2 2639/4885FTO 4787/4885NR1H2 166/4885

“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.