SCHEMBL7868459

SCHEMBL7868459

O=C1OC(=O)C2C(c3ccccc3)C=CC(c3ccccc3)C12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 2/20 0.43
MAPT P10636 5/20 0.42
RAB9A P51151 1/20 0.37
SLC6A3 Q01959 1/20 0.37
LMNA P02545 2/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
HTR2B P41595 1/20 0.37
KDM4E B2RXH2 1/20 0.36
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HTT P42858 1/20 0.36
CA2 P00918 1/20 0.35

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
SCHEMBL16870171 0.81 RAB9A (0.39) POLBMAPTRAB9ASLC6A3LMNA
SCHEMBL18674140 0.81 RAB9A (0.39) POLBMAPTRAB9ASLC6A3LMNA
SCHEMBL19201565 0.81 RAB9A (0.39) POLBMAPTRAB9ASLC6A3LMNA
SCHEMBL16866268 0.81 RAB9A (0.39) POLBMAPTRAB9ASLC6A3LMNA
SCHEMBL21860423 0.81 RAB9A (0.39) POLBMAPTRAB9ASLC6A3LMNA
SCHEMBL10620196 0.78 HDAC4 (0.40) NPSR1MEN1KMT2APOLBMAPT
SCHEMBL10620182 0.78 HDAC4 (0.40) NPSR1MEN1KMT2APOLBMAPT
SCHEMBL13140105 0.74 KDM4E (0.34) RAB9ALMNATP53KDM4ESMN1; SMN2
SCHEMBL4456141 0.74 CYP2C9 (0.40) MAPTRAB9ASLC6A3LMNATP53
SCHEMBL20429730 0.73 SMN1; SMN2 (0.46) MAPTRAB9ASLC6A3LMNATP53

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6303744-B1 NOVEL DICARBOXYLIC ENDCAP SUCH AS 7-HYDROXY-5-NORBORNENE-2,3-DICARBOXYLIC ANHYDRIDE AND 7,7-DIFLOURO-5-NORBORNENE-2,3-DICARBOXYLIC ANHYDRIDE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION 2001-10-16 US disclosed
US-6274699-B1 ENDCAPPING WITH A ISOBENZOFURAN COMPOUND THE UNITED STATES OF AMERICA AS REPRESENTED BY THE ADMINISTRATOR OF THE NATIONAL AERONAUTICS AND SPACE ADMINISTRATION 2001-08-14 US disclosed
US-4507186-A PHOTOCYCLOADDITION OF MALEIC ANHYDRIDE AND CYCLOHEXENEDICARBOXYLIC ANHYDRIDE STANDARD OIL COMPANY (INDIANA) (US) 1985-03-26 US disclosed
US-4417045-A PREPARED FROM TRICYCLO (6.4.0.0(2.7))DODECANE-3,6-DIPHENYL-1,8,4,5-TETRACARBOXYLIC ACID DIANHYDRIDE STANDARD OIL COMPANY (INDIANA) (US) 1983-11-22 US disclosed
US-4393222-A INTERMEDIATES FOR POLYIMIDES STANDARD OIL COMPANY (INDIANA) (US) 1983-07-12 US disclosed
US-4362859-A Polyimides from bicyclo[4.2.0]octane-7,8-dimethyl-3,4,7,8-tetracarboxylic acid dianhydride (I) and bicyclo [4.2.0]octane-2,5 diphenyl-7,8-dimethyl-3,4,7,8-tetracarboxylic dianhydride STANDARD OIL COMPANY (INDIANA) (US) 1982-12-07 US disclosed
US-4358580-A ENGINEERING THERMOPLASTICS; FIBERS; LAMINATION; MOLDING MATERIALS STANDARD OIL COMPANY (INDIANA) (US) 1982-11-09 US disclosed