SCHEMBL7329329

SCHEMBL7329329

CCCC[C@@H](Br)C(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.55
LCK P06239 1/20 0.46
PPARD Q03181 1/20 0.46
ZDHHC20 Q5W0Z9 1/20 0.46
ZDHHC2 Q9UIJ5 1/20 0.46
CA2 P00918 4/20 0.44
CA1 P00915 2/20 0.44
CTSK P43235 9/20 0.42
CTSS P25774 1/20 0.40
TSHR P16473 2/20 0.40
CYP3A4 P08684 1/20 0.40
ATM Q13315 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPK1 P28482 1/20 0.39

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
SCHEMBL2007637 1.00 ZDHHC7 (0.55) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL29772196 0.94 ZDHHC7 (0.62) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL10068415 0.94 ZDHHC7 (0.62) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL9697068 0.93 ZDHHC7 (0.66) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL9691868 0.88 ZDHHC7 (0.44) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL8785206 0.86 ZDHHC7 (0.39) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL6474533 0.85 ZDHHC7 (0.42) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL7894283 0.83 ZDHHC7 (0.44) ZDHHC7LCKPPARDZDHHC20ZDHHC2
SCHEMBL25670282 0.82 CA2 (0.53) CA2CA1CTSKCTSSATM
SCHEMBL14037392 0.81 CYP1A2 (0.44) ZDHHC7CTSKTSHRCYP3A4ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5530161-A TREATING RHEUMATOID ARTHRITIS, PROMOTING WOUND HEALING BRITISH BIO-TECHNOLOGY LIMITED (GB) 1996-06-25 US disclosed
US-5514677-A Hydroxamic acid based collagenase inhibitors BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 1996-05-07 US disclosed
US-5310763-A Wound healing, rheumatoid arthritis BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-05-10 US disclosed
US-5304604-A Treating diseases involving tissue degradation, promoting wound healing BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-04-19 US disclosed
EP-0446267-B1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS BRITISH BIO TECHNOLOGY (GB) 1994-04-13 EP disclosed
EP-0445206-B1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS BRITISH BIO TECHNOLOGY (GB) 1994-03-16 EP disclosed
US-5240958-A HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-08-31 US disclosed
EP-0445206-A1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS. BRITISH BIO TECHNOLOGY (GB) 1991-09-11 EP disclosed
WO-1990005719-A1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-05-31 WO disclosed
WO-1990005716-A1 HYDROXAMIC ACID BASED COLLAGENASE INHIBITORS BRITISH BIO-TECHNOLOGY LIMITED (GB) 1990-05-31 WO disclosed