SCHEMBL15840387

SCHEMBL15840387

CNCC(=O)N[C@@H](CC1CCCCC1)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNB4 P30926 1/20 0.41
CHRNA3 P32297 1/20 0.41
CHRNA4 P43681 1/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRM1 Q13255 1/20 0.41
F2R P25116 1/20 0.40
GRN P28799 1/20 0.40
SORT1 Q99523 1/20 0.40
MAPK11 Q15759 2/20 0.39
MAPK14 Q16539 2/20 0.39
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38

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
SCHEMBL13711061 0.80 CTSK (0.42) MMP1MMP2MMP3GRNSORT1
SCHEMBL13710937 0.80 CTSK (0.42) MMP1MMP2MMP3GRNSORT1
SCHEMBL3617417 0.80 CTSK (0.42) MMP1MMP2MMP3GRNSORT1
SCHEMBL26904745 0.79 CHRNB2 (0.55) MMP1MMP2MMP3CHRNB2CHRNB4
SCHEMBL21101775 0.78 MMP1 (0.44) MMP1MMP2MMP3CHRNB2CHRNB4
SCHEMBL14943563 0.78 PSEN1 (0.41) MMP1MMP2MMP3CHRNB2CHRNB4
SCHEMBL18494010 0.78 CTSL (0.40) MMP1MMP2MMP3GRNSORT1
SCHEMBL4331063 0.78 HPGDS (0.46) MMP1MMP2MMP3CHRNB2CHRNB4
SCHEMBL13735669 0.77 MMP1 (0.47) MMP1MMP2MMP3GRNSORT1
SCHEMBL18435239 0.76 CTSK (0.44) MMP1MMP2MMP3CTSKCPB2

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
WO-2014095773-A1 PEPTIDES AS OXYTOCIN AGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2014-06-26 WO disclosed