SCHEMBL6463634

SCHEMBL6463634

CC(C)(C)[Si](C)(C)OC(c1nc2ccccc2o1)[C@H](CCc1ccccc1)NC(=O)[C@H](CC1CCCCC1)NC(=O)Nc1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.47
CTSS P25774 6/20 0.40
CTSL P07711 4/20 0.40
CTSB P07858 3/20 0.40
REN P00797 3/20 0.39
PSMB5 P28074 7/20 0.36
PSMB11 A5LHX3 1/20 0.35
PSMA7 O14818 1/20 0.35
PSMB1 P20618 1/20 0.35
PSMA1 P25786 1/20 0.35
PSMA2 P25787 1/20 0.35
PSMA3 P25788 1/20 0.35
PSMA4 P25789 1/20 0.35
PSMB8 P28062 1/20 0.35
PSMB9 P28065 1/20 0.35
PSMA5 P28066 1/20 0.35
PSMB4 P28070 1/20 0.35
PSMB6 P28072 1/20 0.35
PSMB10 P40306 1/20 0.35
PSMB3 P49720 1/20 0.35

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
SCHEMBL7048372 0.88 FPR2 (0.52) FPR2CTSSCTSLCTSBREN
SCHEMBL6464251 0.84 REN (0.41) CTSSCTSLCTSBREN
SCHEMBL7183373 0.83 CTSS (0.55) CTSSCTSLCTSB
SCHEMBL7043177 0.81 FPR2 (0.53) FPR2CTSSCTSLCTSBPSMB5
SCHEMBL7044867 0.74 CTSS (0.48) CTSSCTSLCTSBREN
SCHEMBL7109606 0.74 CTSS (0.48) CTSSCTSLCTSBREN
SCHEMBL7049025 0.74 CTSS (0.64) CTSSCTSLCTSBREN
SCHEMBL7047934 0.71 CTSS (0.46) CTSSCTSLCTSBREN
SCHEMBL6467503 0.71 REN (0.33) REN
SCHEMBL7043449 0.70 CTSS (0.63) CTSSCTSLCTSBREN

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
EP-1516877-A1 Amine derivatives as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2005-03-23 EP disclosed
US-20030232864-A1 Novel Compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. (US) 2003-12-18 US disclosed
US-6576630-B1 Alkanoyl substituted benzooxazoles or naphthooxazoles AXYS PHARMACEUTICALS, INC. 2003-06-10 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-20030232864-A1 Novel Compounds and compositions as protease inhibitors SERPINB1, CTRL, CTSZ FPR2 2099/4885CTSS 9/4885CTSL 18/4885

“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.