SCHEMBL13676317

SCHEMBL13676317

CCN[C@H](CO)C(=O)C(C)(C)C

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MMP3 P08254 1/20 0.31
▸ TGFBR1 P36897 2/20 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
SCHEMBL14306752 1.00 MMP3 (0.31) MMP3TGFBR1
SCHEMBL22872358 0.84 CTSS (0.31) —
SCHEMBL13127084 0.84 CTSS (0.31) —
SCHEMBL28099475 0.81 MMP3 (0.30) MMP3
SCHEMBL12301654 0.81 FPR2 (0.35) MMP3
SCHEMBL14374894 0.81 GRN (0.33) —
SCHEMBL10079875 0.81 — —
SCHEMBL12670717 0.81 GRN (0.33) —
SCHEMBL14374242 0.79 MMP3 (0.42) MMP3
SCHEMBL13185094 0.79 — —

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-7598232-B2 Amino-substituted (E)-2,6-dialkoxystyryl 4-substituted-benzylsulfones for treating proliferative disorders TEMPLE UNIVERSITY - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2009-10-06 — — US disclosed
Send feedback