SCHEMBL4540212

SCHEMBL4540212

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
RAB9A P51151 2/20 0.48
HPGD P15428 1/20 0.48
NPSR1 Q6W5P4 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
ELANE P08246 2/20 0.46
GAA P10253 1/20 0.46
STS P08842 1/20 0.45
KMT2A Q03164 4/20 0.44
HRH2 P25021 1/20 0.42
HRH1 P35367 1/20 0.42
NPC1 O15118 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MAOB P27338 2/20 0.41
GLA P06280 1/20 0.41
TSHR P16473 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SIRT5 Q9NXA8 1/20 0.40

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
SCHEMBL27607558 1.00 MAPT (0.48) MAPTRAB9AHPGDNPSR1LMNA
SCHEMBL28954314 1.00 MAPT (0.48) MAPTRAB9AHPGDNPSR1LMNA
Trifluoroacetic Acid SCHEMBL4533126 0.90 PTPN1 (0.43) MAPTRAB9AHPGDNPSR1LMNA
SCHEMBL27277366 0.81 PPARG (0.59) MAPTRAB9AHPGDNPSR1LMNA
SCHEMBL1061790 0.81 ELANE (0.55) MAPTRAB9AHPGDNPSR1LMNA
SCHEMBL28758996 0.81 TDP1 (0.40) MAPTLMNAELANEGAAKMT2A
SCHEMBL6018863 0.81 SLC7A5 (0.42) MAPTELANEGAAKMT2AGLA
SCHEMBL28877801 0.79 CYP1A2 (0.44) LMNAPOLBELANETSHR
SCHEMBL29169947 0.79 SCN9A (0.43) HPGDELANEKMT2ASMN1; SMN2MAOB
SCHEMBL27623103 0.79 LDHA (0.42) MAPTRAB9ANPSR1LMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050261372-A1 Derivatives of glycinergic r(+)-2-amino-3-hydroxypropanoic acid ORAPHARMA, INC. 2005-11-24 US claimed
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 1203/4885RAB9A 2368/4885HPGD 1057/4885

“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.