SCHEMBL17465619

SCHEMBL17465619

COC(=O)[C@H](CCSC)NC(=O)[C@@H](N)CO

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.53
TSHR P16473 1/20 0.49
ALDH1A1 P00352 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
USP2 O75604 1/20 0.47
FNTA P49354 3/20 0.46
FNTB P49356 3/20 0.46
GAA P10253 1/20 0.46
HTT P42858 1/20 0.45
CASP1 P29466 1/20 0.44
TAS1R3 Q7RTX0 2/20 0.44
TAS1R1 Q7RTX1 2/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL21327773 0.85 ALDH1A1 (0.47) CYP2C9TSHRALDH1A1L3MBTL1USP2
SCHEMBL4957483 0.85 ALDH1A1 (0.47) CYP2C9TSHRALDH1A1L3MBTL1USP2
SCHEMBL2549621 0.84 LMNA (0.51) FNTAFNTB
SCHEMBL14500882 0.84 LMNA (0.51) FNTAFNTB
SCHEMBL20335057 0.84 CYP2C9 (0.52) CYP2C9TSHRALDH1A1L3MBTL1USP2
SCHEMBL20335055 0.84 CYP2C9 (0.52) CYP2C9TSHRALDH1A1L3MBTL1USP2
SCHEMBL31307643 0.82 MME (0.46) CYP2C9ALDH1A1CYP2C19
SCHEMBL31307607 0.82 MME (0.46) CYP2C9ALDH1A1CYP2C19
Phosphoric Acid SCHEMBL11686236 0.81 L3MBTL1 (0.45) CYP2C9ALDH1A1L3MBTL1USP2FNTA
SCHEMBL14521501 0.81 CYP2C9 (0.55) CYP2C9TSHRALDH1A1L3MBTL1USP2

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-10442834-B2 Deprotection method AJINOMOTO CO., INC. (JP) 2019-10-15 US disclosed
US-20160024143-A1 DEPROTECTION METHOD AJINOMOTO CO., INC. (JP) 2016-01-28 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 (2 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-10442834-B2 Deprotection method CBR1, AOX1, AOC2 CYP2C9 223/4885TSHR 819/4885ALDH1A1 9/4885
US-20160024143-A1 DEPROTECTION METHOD CBR1, AOX1, AOC2 CYP2C9 223/4885TSHR 819/4885ALDH1A1 9/4885

“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.