SCHEMBL7130920

SCHEMBL7130920

CCC(C)CN(C(=O)N[C@@H](C)C(=O)COCc1ccccc1)C(=O)c1cccc(CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.41
PPARA Q07869 2/20 0.39
NTSR1 P30989 1/20 0.38
PPARG P37231 2/20 0.38
CTSS P25774 1/20 0.37
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
CTSK P43235 2/20 0.35
BACE1 P56817 4/20 0.35
GLS O94925 2/20 0.35
POLB P06746 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
HDAC1 Q13547 1/20 0.34

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
SCHEMBL7133764 0.88 GLS (0.38) SYKNTSR1PPARGMAPTCTSK
SCHEMBL7134725 0.83 CTSK (0.41) SYKNTSR1PPARGCTSSCTSK
SCHEMBL7174119 0.82 CTSK (0.40) SYKPPARGCTSSCTSKGLS
SCHEMBL7136671 0.79 CTSS (0.38) SYKPPARAPPARGCTSSMAPT
SCHEMBL7135455 0.75 CTSB (0.38) CTSSCTSK
SCHEMBL7049086 0.74 CTSS (0.40) CTSSCTSK
SCHEMBL7140706 0.72 CTSK (0.40) CTSSMAPTCTSKBACE1HDAC1
SCHEMBL13315979 0.70 GLS (0.52) SYKPPARANTSR1PPARGCTSS
SCHEMBL7799736 0.69 L3MBTL1 (0.40) SYKPPARAPPARGCTSSMAPT
SCHEMBL6635598 0.69 PPARA (0.63) SYKPPARAPPARGCTSSPOLB

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-20030092634-A1 Novel compounds and compositions as protease inhibitors AXYS PHARMACEUTICALS, INC. 2003-05-15 US disclosed
US-6506733-B1 Which process comprises hydrogenating a compound of Formula 9: presence of a catalytic amount of 20% palladium hydroxide on carbon. AXYS PHARMACEUTICALS, INC. 2003-01-14 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-20030092634-A1 Novel compounds and compositions as protease inhibitors SERPINB1, HPN, CTRL SYK 3422/4885PPARA 4041/4885NTSR1 3625/4885

“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.