SCHEMBL10076052

SCHEMBL10076052

CCC(=O)N[C@H](Cc1ccccc1)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACE P12821 6/20 0.61
MME P08473 2/20 0.59
PSMB5 P28074 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
CPA1 P15085 1/20 0.58
ACE2 Q9BYF1 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
PIN1 Q13526 1/20 0.57
FAAH O00519 2/20 0.56
NAALAD2 Q9Y3Q0 1/20 0.56
ECE1 P42892 1/20 0.56
LMNA P02545 1/20 0.56

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
SCHEMBL4182347 1.00 ACE (0.61) ACEMMEPSMB5L3MBTL1CPA1
SCHEMBL3704677 1.00 ACE (0.61) ACEMMEPSMB5L3MBTL1CPA1
SCHEMBL15692319 0.94 PSMB5 (0.64) ACEMMEPSMB5CPA1ACE2
SCHEMBL7901632 0.92 MME (0.66) ACEMMECPA1ACE2
SCHEMBL7903892 0.92 MME (0.66) ACEMMECPA1ACE2
SCHEMBL17361045 0.89 ACE (0.65) ACEMMEPSMB5L3MBTL1CPA1
SCHEMBL27724295 0.89 ACE (0.65) ACEMMEPSMB5L3MBTL1CPA1
SCHEMBL29337392 0.89 ACE (0.54) ACEMMEPSMB5L3MBTL1CPA1
SCHEMBL8533429 0.88 PSMB5 (0.58) ACEPSMB5
SCHEMBL16473192 0.88 ALDH1A1 (0.60) ACEPSMB5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350175-A Novel acyl phenylalanine derivatives, preparation method thereof and application thereof as medicines 广东药科大学 2025-01-24 CN disclosed
US-8841309-B2 Substituted pyrazines and their use in the treatment of disease BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-09-23 US disclosed
US-8093231-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2012-01-10 US disclosed
US-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES TELIK, INC. 2008-02-14 US disclosed
US-7262182-B2 Sulfonylethyl phosphorodiamidates TELIK, INC. (US) 2007-08-28 US disclosed
US-3983162-A Optical resolution of alkyl esters of DL-phenylalanine G. D. SEARLE & CO. (US) 1976-09-28 US disclosed
US-3941831-A Resolution of alkyl esters of DL-phenylalanine G. D. SEARLE & CO. (US) 1976-03-02 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-20080039429-A1 SULFONYLETHYL PHOSPHORODIAMIDATES MTAP, TYMP, PHOSPHO1 ACE 3043/4885MME 559/4885PSMB5 4631/4885

“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.