SCHEMBL7766007

SCHEMBL7766007

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

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CAD P27708 1/20 0.34
SIRT2 Q8IXJ6 1/20 0.34
TSHR P16473 2/20 0.33
CTSK P43235 2/20 0.33
LMNA P02545 1/20 0.33
CYP3A4 P08684 1/20 0.33
NFKB1 P19838 1/20 0.33
ADRA1A P35348 1/20 0.33
RAB9A P51151 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CTSS P25774 1/20 0.33
CTSL P07711 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALOX15 P16050 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
SCHEMBL7771085 0.85 CAD (0.43) CADSIRT2TSHRCTSKLMNA
SCHEMBL7770030 0.82 KCNA5 (0.40) CTSKCTSSCTSL
SCHEMBL7765999 0.81 CTSK (0.33) CTSKCTSSSMN1; SMN2
SCHEMBL7769907 0.80 CTSK (0.37) CADSIRT2TSHRCTSKLMNA
SCHEMBL8141861 0.79 EPHX1 (0.44) SIRT2RAB9ASMN1; SMN2
SCHEMBL7769348 0.77 TSHR (0.40) CADSIRT2TSHRCTSKLMNA
SCHEMBL7770111 0.77 TSHR (0.35) TSHRLMNACYP3A4NFKB1ADRA1A
SCHEMBL13195777 0.76 CAD (0.44) CADLMNASMN1; SMN2ALOX15
SCHEMBL28879480 0.76 CAD (0.44) CADLMNASMN1; SMN2ALOX15
SCHEMBL28173700 0.76 ALOX15 (0.42) TSHRCTSKLMNACTSSALOX15

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