SCHEMBL7110247

SCHEMBL7110247

Cc1cccc(-c2ccccc2CCC[C@@H](C(=O)N[C@H](C(=O)N[C@@H]2CCc3ccccc32)C(C)(C)C)[C@@H]2OC(C)(C)OC2=O)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.35
NPY1R P25929 3/20 0.33
XIAP P98170 2/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
TAOK1 Q7L7X3 1/20 0.33
TAOK3 Q9H2K8 1/20 0.33
NPY2R P49146 1/20 0.32
NPY5R Q15761 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
MMP2 P08253 4/20 0.32
MMP3 P08254 2/20 0.32
OPRM1 P35372 1/20 0.32
OPRK1 P41145 1/20 0.32
GZMB P10144 1/20 0.32
TAS1R3 Q7RTX0 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
SCHEMBL7110097 0.86 MMP2 (0.35) MMP2MMP3
SCHEMBL7110241 0.85 MMP2 (0.46) MMP2MMP3
SCHEMBL7110242 0.85 MMP2 (0.37) NPY1RXIAPMMP2MMP3EPHX2
SCHEMBL7701844 0.84 MMP2 (0.46) MMP2MMP3
SCHEMBL7108065 0.84 MMP2 (0.46) MMP2MMP3
SCHEMBL7112575 0.82 MMP2 (0.40) MMP2MMP3
SCHEMBL7109657 0.81 MMP2 (0.41) MMP2MMP3
SCHEMBL7111450 0.80 MMP2 (0.40) MMP2MMP3
SCHEMBL7110094 0.70 MMP2 (0.52) MMP2MMP3
SCHEMBL7406837 0.69 MMP2 (0.41) MMP2MMP3

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
EP-1047665-B1 MATRIX METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-10-22 EP disclosed
US-6350907-B1 PEPTIDE ENZYME INHIBITORS PFIZER INC 2002-02-26 US disclosed