SCHEMBL4533122

SCHEMBL4533122

CC(=O)c1ccc(OC(=O)[C@H](N)COC(=O)C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.43
NPSR1 Q6W5P4 2/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
MAOB P27338 4/20 0.40
RAB9A P51151 2/20 0.40
HPGD P15428 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.39
ELANE P08246 1/20 0.39
MAOA P21397 1/20 0.39
KMT2A Q03164 4/20 0.38
STS P08842 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.37
NPC1 O15118 1/20 0.36

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
Trifluoroacetic Acid SCHEMBL4533126 0.81 PTPN1 (0.43) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL27607558 0.78 MAPT (0.48) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL4540212 0.78 MAPT (0.48) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL28954314 0.78 MAPT (0.48) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL9541160 0.77 MAPT (0.55) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL27277366 0.73 PPARG (0.59) MAPTNPSR1LMNAMAOBRAB9A
SCHEMBL1061790 0.73 ELANE (0.55) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL11353462 0.71 KIF11 (0.35) SMN1; SMN2
SCHEMBL23128932 0.68 MAOB (0.39) MAPTNPSR1LMNAPOLBMAOB
SCHEMBL27547041 0.68 MAPT (0.52) MAPTNPSR1LMNAPOLBMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7488755-B2 Derivatives of glycinergic R(+)-2-amino-3-hydroxypropanoic acid PRESTWICK PHARMACEUTICALS, INC. (US) 2009-02-10 US disclosed
US-20050261372-A1 Derivatives of glycinergic r(+)-2-amino-3-hydroxypropanoic acid ORAPHARMA, INC. 2005-11-24 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-20050261372-A1 Derivatives of glycinergic r(+)-2-amino-3-hydroxypropanoic acid GLRA3, GLRA1, GLRA2 MAPT 1203/4885NPSR1 442/4885LMNA 1379/4885

“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.