SCHEMBL7073285

SCHEMBL7073285

CC(C)(C)C1(C(=O)O)CC2C=CC1C2.CCCN1C(=O)C=CC1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
PTGS1 P23219 7/20 0.33
PTGS2 P35354 7/20 0.33
MGLL Q99685 4/20 0.33
FAAH O00519 2/20 0.33
KDM4E B2RXH2 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
SCHEMBL7077372 0.91 PTGS1 (0.47) PTGS1PTGS2MGLLFAAH
SCHEMBL1206903 0.81 CYP2D6 (0.36) CYP2D6CYP2C19
SCHEMBL6318704 0.80 MGLL (0.37) PTGS1PTGS2MGLLFAAH
Maleic Anhydride SCHEMBL6318484 0.78 CYP2D6 (0.32) CYP2D6CYP2C19
SCHEMBL8106173 0.73 PTGS1 (0.32) PTGS1PTGS2
SCHEMBL6403313 0.69 KDM4E (0.38) KDM4E
SCHEMBL4559028 0.69
Maleic Anhydride SCHEMBL7878989 0.69
SCHEMBL14142588 0.67
SCHEMBL2476669 0.66 CYP2D6 (0.32) 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-20030013037-A1 Maleimide-photoresist monomers containing halogen, polymers thereof and photoresist compositions comprising the same HYNIX SEMICONDUCTOR INC. (KR) 2003-01-16 US claimed
US-20030013037-A1 Maleimide-photoresist monomers containing halogen, polymers thereof and photoresist compositions comprising the same HYNIX SEMICONDUCTOR INC. (KR) 2003-01-16 US disclosed