SCHEMBL6325212

SCHEMBL6325212

CC(C)(C)OC(=O)C1(C(=O)O)CC2C=CC1C2

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
MEN1 O00255 1/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 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
Maleic Anhydride SCHEMBL6319349 0.89 NFKB1 (0.33)
SCHEMBL7703026 0.83 MAPT (0.37) CYP2D6CYP2C19
SCHEMBL6319342 0.82
SCHEMBL6429482 0.80 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL9079943 0.80 CYP2D6 (0.37) CYP2D6CYP2C19
SCHEMBL27619844 0.79 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL1451420 0.78 P2RX7 (0.37) CYP2D6CYP2C19MEN1MAPK1KMT2A
SCHEMBL13525991 0.77 CYP2D6 (0.33) CYP2D6CYP2C19MEN1MAPK1KMT2A
SCHEMBL15423563 0.77 MAPK1 (0.34) MEN1MAPK1KMT2A
SCHEMBL5838268 0.75 CYP2D6 (0.33) CYP2D6CYP2C19

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
US-6841488-B2 Pattern formation method MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2005-01-11 US disclosed
US-20030082926-A1 Pattern formation method MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2003-05-01 US disclosed