SCHEMBL7769907

SCHEMBL7769907

CCC(NC(=O)OC)C(N)=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSK P43235 3/20 0.37
CTSS P25774 2/20 0.37
CAD P27708 1/20 0.34
CA1 P00915 4/20 0.33
CA2 P00918 4/20 0.33
MMP1 P03956 2/20 0.33
MMP2 P08253 2/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
GAA P10253 1/20 0.33
MMP8 P22894 1/20 0.33
EPHX1 P07099 1/20 0.32
MMP3 P08254 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
FOLH1 Q04609 1/20 0.31
ACACB O00763 1/20 0.31
ALOX15 P16050 1/20 0.31
ECE1 P42892 1/20 0.31
LMNA P02545 2/20 0.31
CA3 P07451 1/20 0.31

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
SCHEMBL890124 0.84 CTSK (0.38) CTSKCTSSCA1CA2MMP1
SCHEMBL8570963 0.84 CTSK (0.38) CTSKCTSSCA1CA2MMP1
SCHEMBL890147 0.84 CTSK (0.38) CTSKCTSSCA1CA2MMP1
SCHEMBL7771085 0.83 CAD (0.43) CTSKCTSSCADGAASIRT2
SCHEMBL28173700 0.82 ALOX15 (0.42) CTSKCTSSFOLH1ALOX15LMNA
SCHEMBL7766007 0.80 CAD (0.34) CTSKCTSSCADSIRT2ALOX15
SCHEMBL18925259 0.80 CTSK (0.58) CTSKCTSSCA1CA2CA7
SCHEMBL5532831 0.80 CTSK (0.58) CTSKCTSSCA1CA2CA7
SCHEMBL18892598 0.80 CTSK (0.58) CTSKCTSSCA1CA2CA7
SCHEMBL13993116 0.80 CA1 (0.41) CTSKCTSSCA1CA2MMP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0765879-B1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO CO (JP) 2001-02-14 EP disclosed
US-5861429-A MITICIDES AND ANTHELMINTICS SANKYO COMPANY, LIMITED (JP) 1999-01-19 US disclosed
EP-0765879-A1 13-Substituted milbemycin 5-oxime derivatives, their preparation and their use against insects and other pests SANKYO COMPANY LIMITED (JP) 1997-04-02 EP disclosed