SCHEMBL6963239

SCHEMBL6963239

CC(C)(C)C(CC(=O)O)NC(=O)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 9/20 0.53
SYK P43405 1/20 0.52
CTRB1 P17538 2/20 0.51
ATM Q13315 1/20 0.51
ELANE P08246 1/20 0.51
CTSL P07711 1/20 0.51
CTSB P07858 1/20 0.51
CTSS P25774 1/20 0.51
CASP3 P42574 1/20 0.50
CTSK P43235 1/20 0.49

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
SCHEMBL7389166 0.90 SYK (0.51) CASP1SYKCTRB1ATMELANE
SCHEMBL7681968 0.90 SYK (0.51) CASP1SYKCTRB1ATMELANE
SCHEMBL14569563 0.87 CTRB1 (0.59) SYKCTRB1ATMELANECTSL
SCHEMBL12564718 0.87 SYK (0.60) SYKCTRB1ATMELANECTSL
SCHEMBL21372402 0.87 SYK (0.53) SYKCTRB1ATMELANECTSL
SCHEMBL13219608 0.87 SYK (0.60) SYKCTRB1ATMELANECTSL
SCHEMBL13036482 0.87 CTRB1 (0.59) SYKCTRB1ATMELANECTSL
SCHEMBL12142665 0.87 SYK (0.53) SYKCTRB1ATMELANECTSL
SCHEMBL12798896 0.87 SYK (0.57) CASP1SYKCTRB1ATMELANE
SCHEMBL13036484 0.86 CTSK (0.62) SYKATMELANECTSLCTSB

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-1021424-B1 THIADIAZOLE AMIDE MMP INHIBITORS UPJOHN CO (US) 2003-02-26 EP disclosed
EP-1021424-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 2000-07-26 EP disclosed
WO-1997048688-A1 THIADIAZOLE AMIDE MMP INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-12-24 WO disclosed