SCHEMBL10614799

SCHEMBL10614799

CC(Br)C(=O)OC(C)P(=O)(O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 1/20 0.32
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
CA9 Q16790 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
SCHEMBL20490108 0.83 LAP3 (0.33) LAP3CA12CA1CA2MMP1
SCHEMBL10614235 0.77 LAP3 (0.34) LAP3CA12CA1CA2MMP1
SCHEMBL20490109 0.76 LAP3 (0.37) LAP3CA12CA1CA2MMP1
SCHEMBL8416129 0.75 TSHR (0.50) LAP3CA12CA1CA2MMP1
SCHEMBL10616577 0.74 FBP1 (0.38) LAP3
SCHEMBL10617057 0.74 FDPS (0.41) LAP3
SCHEMBL10471153 0.74
SCHEMBL435015 0.74 TSHR (0.35)
SCHEMBL1778572 0.72
SCHEMBL10614783 0.70 SRC (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4787929-A POSTEMERGENCE BAYER AKTIENGESELLSCHAFT (DE) 1988-11-29 US disclosed
US-4670040-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DE) 1987-06-02 US disclosed