SCHEMBL1726734

SCHEMBL1726734

CCCC(CCN1CCOCC1)C(N)=O

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.58
▸ ALDH1A1 P00352 3/20 0.46
▸ KDM4E B2RXH2 4/20 0.44
▸ GLA P06280 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ MAPT P10636 1/20 0.39
▸ KEAP1 Q14145 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.37

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
Oxalic Acid SCHEMBL29685154 0.95 TSHR (0.55) TSHRALDH1A1KDM4EGLAGAA
Sulfuric Acid SCHEMBL29684657 0.94 TSHR (0.53) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL28231556 0.93 TSHR (0.56) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL29684786 0.90 TSHR (0.50) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL1819502 0.89 TSHR (0.49) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL2435688 0.89 ALDH1A1 (0.54) TSHRALDH1A1KDM4EGLAGAA
Gluconic Acid SCHEMBL29684835 0.83 TSHR (0.44) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL29684863 0.83 ALDH1A1 (0.47) TSHRALDH1A1KDM4EGAASMN1; SMN2
SCHEMBL4405073 0.78 ALDH1A1 (0.50) TSHRALDH1A1KDM4EGLAGAA
SCHEMBL14562932 0.78 ALDH1A1 (0.50) TSHRALDH1A1KDM4EGLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024192470-A1 METHOD OF TREATING GLIOBLASTOMA OR OTHER CANCERS EXPRESSING P75 NEUROTROPHIN RECEPTOR THE UNIVERSITY OF NEWCASTLE (AU) 2024-09-26 — — WO disclosed
US-20220162177-A1 CRYSTALLINE FORMS OF NEUROTROPHIN MIMETIC COMPOUNDS AND THEIR SALTS PHARMATROPHIX, INC. 2022-05-26 — — US disclosed
EP-2498782-B1 CRYSTALLINE FORMS OF NEUROTROPHIN MIMETIC COMPOUNDS AND THEIR SALTS PHARMATROPHIX INC (US) 2019-01-09 — — EP disclosed
CN-108383804-A The crystal form of neurotrophin simulated compound and its salt 特罗菲克斯制药股份有限公司 2018-08-10 — — CN disclosed
CN-104761515-B The crystal formation of neurotrophin simulated compound and its salt 特罗菲克斯制药股份有限公司 2018-03-09 — — CN disclosed
WO-2012167869-A1 AMINO LIPIDS, THEIR SYNTHESIS AND USES THEREOF Karlsruher Institut für Technologie (DE) 2012-12-13 — — WO disclosed
EP-2403839-A2 NEUROTROPHIN MIMETICS AND USES THEREOF The University of North Carolina At Chapel Hill (US) 2012-01-11 — — EP disclosed
WO-2011066544-A2 DEUTERATED COMPOUNDS USEFUL FOR TREATING NEURODEGENERATIVE DISEASES PHARMATROPHIX, INC. (US) 2011-06-03 — — 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-20220162177-A1 CRYSTALLINE FORMS OF NEUROTROPHIN MIMETIC COMPOUNDS AND THEIR SALTS BDNF, NGF, NTRK2 TSHR 971/4885ALDH1A1 4364/4885KDM4E 1552/4885

“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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