SCHEMBL17612840

SCHEMBL17612840

CCC(C)(C)CC(C(=O)NC)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA7 P43166 2/20 0.33
CA14 Q9ULX7 2/20 0.33
MMP3 P08254 17/20 0.33
MMP1 P03956 14/20 0.33
MMP2 P08253 12/20 0.33
MMP7 P09237 5/20 0.33
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
MMP9 P14780 7/20 0.31
MMP8 P22894 3/20 0.31
MMP13 P45452 3/20 0.31
MMP20 O60882 1/20 0.30
ADAMTS4 O75173 1/20 0.30
TNF P01375 1/20 0.30
MMP10 P09238 1/20 0.30
MMP12 P39900 1/20 0.30
MMP14 P50281 1/20 0.30
MMP15 P51511 1/20 0.30

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
SCHEMBL14339479 0.86
SCHEMBL14354592 0.86 MMP3 (0.32) MMP3MMP1MMP2MMP7MMP9
SCHEMBL19363841 0.82 POLB (0.31)
SCHEMBL10005812 0.81 MMP3 (0.33) CA1CA2CA7CA14MMP3
SCHEMBL10093700 0.81 MEN1 (0.32)
SCHEMBL10093688 0.79
SCHEMBL14261034 0.79 CA1 (0.47) CA1CA2CA7CA14MMP3
SCHEMBL16707108 0.79 CA1 (0.47) CA1CA2CA7CA14MMP3
SCHEMBL14748203 0.78
SCHEMBL12830516 0.77 CA2 (0.31) CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2131239-B1 Processing liquid for lithographic printing plate development and method of producing lithographic printing plates FUJIFILM CORP (JP) 2016-03-23 EP disclosed