SCHEMBL1110119

SCHEMBL1110119

CC1CC(C)(C)C(=O)[C@H](O)C1=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ENO1 P06733 1/20 0.32
PTPN1 P18031 1/20 0.31
NR2F2 P24468 1/20 0.30

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
SCHEMBL1110020 1.00 ENO1 (0.32) ENO1PTPN1NR2F2
SCHEMBL1110705 0.81 NR2F2 (0.33) ENO1PTPN1NR2F2
SCHEMBL2689523 0.76
SCHEMBL1573211 0.74 APLNR (0.30)
SCHEMBL25101385 0.71
SCHEMBL960112 0.70 ENO1 (0.32) ENO1PTPN1
SCHEMBL5713354 0.70 ENO1 (0.32) ENO1PTPN1
SCHEMBL6720724 0.70 ENO1 (0.32) ENO1PTPN1
SCHEMBL8677887 0.70 ENO1 (0.32) ENO1PTPN1
SCHEMBL7838483 0.70 ENO1 (0.32) ENO1PTPN1

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-2279291-A2 COFERONS AND METHODS OF MAKING AND USING THEM Cornell University (US) 2011-02-02 EP disclosed
WO-2009126290-A2 COFERONS AND METHODS OF MAKING AND USING THEM CORNELL UNIVERSITY (US) 2009-10-15 WO disclosed