SCHEMBL9880209

SCHEMBL9880209

C/C(=C\CC[C@]1(C)Oc2c(c(O)cc3c2CN(CCO)C3=O)C[C@@H]1O)CCC(O)C(C)(C)O

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PTPN2 P17706 1/20 0.40
▸ PTPN1 P18031 1/20 0.40
▸ PTPN6 P29350 1/20 0.40
▸ ALOX5 P09917 1/20 0.34
▸ DHODH Q02127 1/20 0.34
▸ APP P05067 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ CYP3A4 P08684 2/20 0.32

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
SCHEMBL29425569 1.00 PTPN2 (0.40) PTPN2PTPN1PTPN6ALOX5DHODH
SCHEMBL22863341 0.91 PTPN2 (0.38) PTPN2PTPN1PTPN6ALOX5DHODH
SCHEMBL22863342 0.91 PTPN2 (0.38) PTPN2PTPN1PTPN6ALOX5DHODH
SCHEMBL22863326 0.88 APP (0.35) PTPN1ALOX5APPBACE1
SCHEMBL15744228 0.88 APP (0.35) PTPN1ALOX5APPBACE1
SCHEMBL9880208 0.88 APP (0.35) PTPN1ALOX5APPBACE1
SCHEMBL29406722 0.88 APP (0.35) PTPN1ALOX5APPBACE1
SCHEMBL21538153 0.86 ALOX5 (0.46) PTPN2PTPN1PTPN6ALOX5
SCHEMBL22863219 0.82 PTPN2 (0.42) PTPN2PTPN1PTPN6ALOX5DHODH
SCHEMBL22863224 0.82 ALOX5 (0.33) ALOX5

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 6 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-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
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 PTPN2 4507/4885PTPN1 4567/4885PTPN6 4627/4885

“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.

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