SCHEMBL14519219

SCHEMBL14519219

CCCNC(=O)CCC(NC)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 7/20 0.52
▸ MMP9 P14780 7/20 0.52
▸ MMP8 P22894 4/20 0.52
▸ MMP12 P39900 4/20 0.52
▸ MMP14 P50281 4/20 0.52
▸ NOD1 Q9Y239 4/20 0.45
▸ ALDH1A1 P00352 1/20 0.44
▸ CASP2 P42575 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ CNR1 P21554 1/20 0.38
▸ GLP1R P43220 2/20 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
SCHEMBL22026231 0.90 MMP2 (0.54) MMP2MMP9MMP8MMP12MMP14
SCHEMBL15783568 0.88 CASP2 (0.56) MMP2MMP9MMP8MMP12MMP14
Hydrochloric Acid SCHEMBL23834203 0.87 CASP2 (0.54) MMP2MMP9MMP8MMP12MMP14
SCHEMBL19401685 0.86 CASP2 (0.47) MMP2MMP9MMP8MMP12MMP14
SCHEMBL22134382 0.84 LMNA (0.48) MMP2MMP9MMP8MMP12MMP14
SCHEMBL25589816 0.84 ALDH1A1 (0.43) MMP2MMP9MMP8MMP12MMP14
SCHEMBL14118034 0.84 FOLH1 (0.51) MMP2MMP9MMP8MMP12MMP14
SCHEMBL15783567 0.83 NOD1 (0.62) MMP2MMP9MMP8MMP12MMP14
SCHEMBL12580525 0.81 FOLH1 (0.42) MMP2MMP9MMP8MMP12MMP14
SCHEMBL18738812 0.81 MMP2 (0.49) MMP2MMP9MMP8MMP12MMP14

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-7198958-B2 Method for increasing hydrophilicity of fluorescent label compounds ARCTIC DIAGNOSTICS OY (FI) 2007-04-03 — — US disclosed
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