SCHEMBL4481740

SCHEMBL4481740

CC(C)C[C@@H](C(=O)NN)[C@@H](C(=O)NO)C(/C=C/c1ccccc1)(CC(C)C)S(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADAM17 P78536 7/20 0.46
CYP2C19 P33261 1/20 0.36
LTA4H P09960 1/20 0.35
ANPEP P15144 1/20 0.35
MMP2 P08253 7/20 0.35
MMP3 P08254 7/20 0.35
MMP7 P09237 5/20 0.35
MMP1 P03956 7/20 0.35
MMP9 P14780 2/20 0.35
MMP14 P50281 2/20 0.35
FCER2 P06734 1/20 0.35
MMP8 P22894 3/20 0.35
MMP12 P39900 1/20 0.35
MMP13 P45452 1/20 0.35
LARS1 Q9P2J5 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
SCHEMBL6942610 1.00 ADAM17 (0.46) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL6945409 0.92 ADAM17 (0.43) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL6945999 0.92 ADAM17 (0.43) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL6941767 0.92 ADAM17 (0.46) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL6942998 0.90 ADAM17 (0.44) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL6940092 0.90 ADAM17 (0.44) ADAM17ANPEPMMP2MMP3MMP7
SCHEMBL6942446 0.90 ADAM17 (0.46) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL8097996 0.90 ADAM17 (0.46) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL6947093 0.90 ADAM17 (0.46) ADAM17CYP2C19LTA4HANPEPMMP2
SCHEMBL7104723 0.89 ADAM17 (0.44) ADAM17LTA4HANPEPMMP2MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090274626-A1 TARGETING TNF-alpha CONVERTING ENZYME(TACE)- DEPENDENT GROWTH FACTOR SHEDDING IN CANCER THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-11-05 US claimed
WO-2007016597-A2 TARGETING TNF-ALPHA CONVERTING ENZYME (TACE)-DEPENDENT GROWTH FACTOR SHEDDING IN CANCER THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-02-08 WO claimed
EP-0993442-B1 HYDRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2003-04-23 EP claimed
US-6235787-B1 ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; BONE DISORDERS; SKIN DISORDERS; MULTIPLE SCLEROSIS HOFFMANN-LA ROCHE INC. 2001-05-22 US claimed
EP-0993442-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-04-19 EP claimed
WO-1999001428-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-01-14 WO claimed
US-20240156867-A1 ENGINEERED IMMUNE CELL THERAPEUTICS AND METHODS OF USE Catamaran Bio, Inc. 2024-05-16 US disclosed
US-20090274626-A1 TARGETING TNF-alpha CONVERTING ENZYME(TACE)- DEPENDENT GROWTH FACTOR SHEDDING IN CANCER THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-11-05 US disclosed
WO-2007016597-A2 TARGETING TNF-ALPHA CONVERTING ENZYME (TACE)-DEPENDENT GROWTH FACTOR SHEDDING IN CANCER THERAPY THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-02-08 WO disclosed
US-20050019743-A1 Compounds and methods for improving platelet recovery and function CENTER FOR BLOOD RESEARCH, INC. 2005-01-27 US disclosed
WO-2004105837-A2 COMPOUNDS AND METHODS FOR IMPROVING PLATELET RECOVERY AND FUNCTION CENTER FOR BLOOD RESEARCH, INC. (US) 2004-12-09 WO disclosed
WO-2004037286-A2 COMBINATION OF A TRIOXOPYRIMIDINE COMPOUND INHIBITOR AND AN ANTI-TUMOR AGENT, AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2004-05-06 WO disclosed
EP-0993442-B1 HYDRAZINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2003-04-23 EP disclosed
US-6235787-B1 ANTIINFLAMMATORY AGENTS; RHEUMATIC DISEASES; BONE DISORDERS; SKIN DISORDERS; MULTIPLE SCLEROSIS HOFFMANN-LA ROCHE INC. 2001-05-22 US disclosed
EP-0993442-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2000-04-19 EP disclosed
WO-1999001428-A1 HYDRAZINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-01-14 WO disclosed