SCHEMBL8388151

SCHEMBL8388151

CCCCCCCCCCCCCCC(CCC)C(Br)C(=O)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
CES2 O00748 3/20 0.45
CES1 P23141 3/20 0.45
PRSS1 P07477 3/20 0.45
CTSG P08311 2/20 0.45
CTRB1 P17538 2/20 0.45
CMA1 P23946 2/20 0.45
NAAA Q02083 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44
SLC6A2 P23975 1/20 0.43
SLC6A3 Q01959 1/20 0.43
PRSS2 P07478 1/20 0.42
PRSS3 P35030 1/20 0.42
ALDH1A1 P00352 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41

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
SCHEMBL11110648 0.91 SLC6A2 (0.50) CES2CES1PRSS1CTSGCTRB1
SCHEMBL27741659 0.87 MMP2 (0.47) MMP2MMP9MMP12CES2CES1
SCHEMBL2871593 0.81 LCK (0.58) MMP2MMP9MMP12CES2CES1
SCHEMBL11754693 0.81 LCK (0.58) MMP2MMP9MMP12CES2CES1
SCHEMBL8992310 0.81 SLC6A2 (0.44) MMP2MMP9MMP12CES2CES1
SCHEMBL1248513 0.80 LCK (0.55) MMP2MMP9MMP12CES2CES1
SCHEMBL6582853 0.79 MMP2 (0.48) MMP2MMP9MMP12CES2CES1
SCHEMBL8531764 0.79 MMP2 (0.48) MMP2MMP9MMP12CES2CES1
SCHEMBL9155484 0.79 MMP2 (0.48) MMP2MMP9MMP12CES2CES1
SCHEMBL11053944 0.78 SLC6A2 (0.48) MMP2MMP9MMP12CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0803083-B1 IMAGE-RECORDING MATERIALS POLAROID CORP (US) 1999-04-21 EP disclosed
EP-0803083-A1 IMAGE-RECORDING MATERIALS POLAROID CORPORATION (US) 1997-10-29 EP disclosed
US-5674986-A FOR HEAT-DEVELOPABLE PHOTOSENSITIVE IMAGE-RECORDING MATERIALS POLAROID CORPORATION (US) 1997-10-07 US disclosed
WO-1997018497-A1 IMAGE-RECORDING MATERIALS POLAROID CORPORATION (US) 1997-05-22 WO disclosed
US-5569574-A CONTAINING CYCLIC 1,3-SULFUR-OXYGEN MOIETY; DIFFUSION TRANSFER PROCESSES POLAROID CORPORATION (US) 1996-10-29 US disclosed