SCHEMBL16601950

SCHEMBL16601950

CC(C)OP(=O)(OC(C)C)C(=O)NCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.57
CA2 P00918 7/20 0.57
CA9 Q16790 7/20 0.57
CA12 O43570 6/20 0.57
CA1 P00915 6/20 0.57
MMP13 P45452 5/20 0.50
ADAMTS4 O75173 4/20 0.50
MMP14 P50281 3/20 0.50
MMP1 P03956 3/20 0.50
ADAMTS5 Q9UNA0 2/20 0.50
MEP1B Q16820 1/20 0.50
MMP9 P14780 4/20 0.49
MMP3 P08254 3/20 0.46
TARS1 P26639 1/20 0.46
MMP7 P09237 1/20 0.46
BCL2L1 Q07817 2/20 0.44
MCL1 Q07820 2/20 0.44
CTSK P43235 2/20 0.43
CTSS P25774 1/20 0.43
MMP8 P22894 2/20 0.43

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
SCHEMBL10029051 0.90 MMP2 (0.71) MMP2CA2CA9CA12CA1
SCHEMBL569752 0.88 MMP2 (0.72) MMP2CA2CA9CA12CA1
SCHEMBL568567 0.88 MMP2 (0.72) MMP2CA2CA9CA12CA1
SCHEMBL16601947 0.85 MMP2 (0.58) MMP2CA2CA9CA12CA1
SCHEMBL569412 0.84 MMP2 (0.56) MMP2CA2CA9CA12CA1
SCHEMBL16601946 0.83 MMP2 (0.65) MMP2CA2CA9CA12CA1
SCHEMBL3712936 0.80 MMP2 (0.51) MMP2CA2CA9CA12CA1
SCHEMBL569308 0.79 MMP2 (0.50) MMP2CA2CA9CA12CA1
SCHEMBL569306 0.79 MMP2 (0.50) MMP2CA2CA9CA12CA1
SCHEMBL569487 0.79 MMP2 (0.50) MMP2CA2CA9CA12CA1

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
US-8993544-B2 Carbamoylphosphonates as inhibitors and uses thereof YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM, LTD. (IL) 2015-03-31 US disclosed