SCHEMBL16601947

SCHEMBL16601947

CCOP(=O)(OCC)C(=O)NCNS(=O)(=O)c1ccc(Oc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 9/20 0.58
▸ CA2 P00918 6/20 0.58
▸ CA9 Q16790 6/20 0.58
▸ CA12 O43570 5/20 0.58
▸ CA1 P00915 5/20 0.58
▸ ADAMTS4 O75173 3/20 0.51
▸ MMP13 P45452 3/20 0.51
▸ MMP14 P50281 2/20 0.51
▸ ADAMTS5 Q9UNA0 2/20 0.51
▸ MMP1 P03956 2/20 0.51
▸ MEP1B Q16820 1/20 0.51
▸ BCL2L1 Q07817 3/20 0.44
▸ MCL1 Q07820 3/20 0.44
▸ MMP9 P14780 2/20 0.44
▸ HTT P42858 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ STAT3 P40763 1/20 0.42

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
SCHEMBL569418 0.89 MMP2 (0.69) MMP2CA2CA9CA12CA1
SCHEMBL10029052 0.88 MMP2 (0.74) MMP2CA2CA9CA12CA1
SCHEMBL570025 0.87 MMP2 (0.74) MMP2CA2CA9CA12CA1
SCHEMBL569547 0.87 MMP2 (0.74) MMP2CA2CA9CA12CA1
SCHEMBL16601950 0.85 MMP2 (0.57) MMP2CA2CA9CA12CA1
SCHEMBL10029068 0.85 MMP2 (0.76) MMP2CA2CA9CA12CA1
SCHEMBL16601946 0.84 MMP2 (0.65) MMP2CA2CA9CA12CA1
SCHEMBL15876407 0.81 MMP2 (0.56) MMP2CA2CA9CA12CA1
SCHEMBL16601948 0.80 MMP2 (0.62) MMP2CA2CA9CA12CA1
SCHEMBL10029053 0.80 MMP2 (0.76) 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
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