SCHEMBL20284366

SCHEMBL20284366

CC(C)CC[C@H](NC(=O)[C@@H](N)CCc1ccccc1)C(=O)N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSL P07711 2/20 0.52
FPR2 P25090 1/20 0.51
ACE P12821 7/20 0.48
MME P08473 4/20 0.48
CPA1 P15085 4/20 0.48
ACE2 Q9BYF1 4/20 0.48
NPY1R P25929 1/20 0.45
NPY2R P49146 1/20 0.45
NPY4R P50391 1/20 0.45
BACE1 P56817 1/20 0.44
CTSK P43235 1/20 0.44
MMP1 P03956 1/20 0.43
MMP3 P08254 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
SCHEMBL8267315 0.92 CTSL (0.52) CTSLFPR2ACEMMECPA1
SCHEMBL21793845 0.89 ACE (0.53) FPR2ACEMMECPA1ACE2
SCHEMBL17948645 0.82 LTA4H (0.58) MMENPY1RNPY2RNPY4RBACE1
SCHEMBL21793846 0.82 CYP3A4 (0.62)
Hydrochloric Acid SCHEMBL19741503 0.81 LTA4H (0.57) MMENPY1RNPY2RNPY4RBACE1
Hydrochloric Acid SCHEMBL19741504 0.81 LTA4H (0.57) MMENPY1RNPY2RNPY4RBACE1
SCHEMBL20284364 0.81 ACE (0.54) FPR2ACEMMECPA1ACE2
SCHEMBL8266322 0.81 ACE (0.54) FPR2ACEMMECPA1ACE2
SCHEMBL10129680 0.81 MMP3 (0.54) ACEMMECPA1ACE2NPY1R
SCHEMBL22503664 0.80 ACE (0.59) CTSLACEMMECPA1ACE2

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-20200071356-A1 COMPOUNDS FOR PROTEASOME PROTEOLIX, INC. 2020-03-05 US disclosed
US-20180170962-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION ONYX THERAPEUTICS INC (US) 2018-06-21 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-20180170962-A1 COMPOUNDS FOR PROTEASOME ENZYME INHIBITION PSMB1, PSMB9, PSMB3 CTSL 372/4885FPR2 1197/4885ACE 347/4885
US-20200071356-A1 COMPOUNDS FOR PROTEASOME PSMB1, PSMB9, PSMB2 CTSL 472/4885FPR2 1057/4885ACE 918/4885

“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.