SCHEMBL12809459

SCHEMBL12809459

CCC[C@H](/C=C/C(=O)Cc1ccc(F)cc1)NC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CTSK P43235 15/20 0.44
CTSS P25774 1/20 0.44
TDP1 Q9NUW8 1/20 0.40
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
KDM4E B2RXH2 1/20 0.39

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
SCHEMBL11929409 0.94 CTSK (0.50) CTSK
SCHEMBL1401076 0.88 CTSK (0.41) CTSKCTSSTDP1MEN1LMNA
SCHEMBL1401074 0.88 CTSK (0.41) CTSKCTSSTDP1MEN1LMNA
SCHEMBL10266406 0.87 CTSK (0.40) CTSKCTSSMEN1LMNATSHR
SCHEMBL11929410 0.79 CTSK (0.51) CTSKCTSS
SCHEMBL29679376 0.77 CTSK (0.54) CTSK
SCHEMBL2546240 0.75 CTSK (0.48) CTSKCTSS
SCHEMBL5468267 0.75 CTSK (0.48) CTSKCTSS
SCHEMBL1401046 0.74 CTSK (0.46) CTSKCTSSMEN1LMNATSHR
SCHEMBL1401049 0.74 CTSK (0.46) CTSKCTSSMEN1LMNATSHR

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
EP-1417975-B1 REMEDIES FOR DISEASES WITH BONE MASS LOSS HAVING EP4 AGONIST AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO (JP) 2011-03-02 EP disclosed