SCHEMBL1063100

SCHEMBL1063100

O=C(O)CN1C(=O)C=C(N2C(=O)CCC2=O)C1=O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.43
CA12 O43570 2/20 0.40
CA9 Q16790 2/20 0.40
KMT2A Q03164 4/20 0.37
MEN1 O00255 3/20 0.37
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA1 P00915 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
MAPT P10636 1/20 0.35
AKR1B1 P15121 1/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.33

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
SCHEMBL28299304 0.81 PTGS1 (0.44) KMT2AMEN1SMN1; SMN2KDM4EALDH1A1
SCHEMBL9435785 0.74 BACE1 (0.36) KMT2AMEN1ALDH1A1
SCHEMBL5481100 0.74 CA12 (0.38) CA12CA9KMT2ACA1
SCHEMBL236431 0.71 TSHR (0.56) TSHRCA12CA9KMT2AMEN1
SCHEMBL8891742 0.69 CA12 (0.50) TSHRCA12CA9KMT2AMEN1
SCHEMBL4847030 0.69 RGS4 (0.53) TSHRCA12CA9KMT2AMEN1
SCHEMBL8467551 0.68 CA12 (0.48) CA12CA9KMT2AMEN1SMN1; SMN2
SCHEMBL19583420 0.67 CA12 (0.32) CA12CA9CA1ALDH1A1HTT
SCHEMBL1055378 0.67 TSHR (0.43) TSHRCA12CA9KMT2AMEN1
SCHEMBL15741868 0.67 CA12 (0.68) CA12CA9KMT2AMEN1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-63059891-A None JP disclosed
JP-61103838-A None JP disclosed
US-20110008814-A1 Enzyme Immunoassay Using Enzyme-Labeled Antibody KIKKOMAN CORPORATION (JP) 2011-01-13 US disclosed
US-4868106-A IMMUNOASSAY, POROUS REACTION LAYER KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1989-09-19 US disclosed
JP-S6359891-A IMMOBILIZATION OF SUBSTANCE ORIENTAL YEAST CO LTD 1988-03-15 JP disclosed
JP-S61103838-A IMMUNE ADSORBENT AND ITS PRODUCTION ORIENTAL YEAST CO LTD 1986-05-22 JP disclosed