SCHEMBL28516403

SCHEMBL28516403

O=c1c2ccc(Cl)cc2cc(-c2ccccc2)n1-c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.50
MAT2A P31153 4/20 0.47
TSHR P16473 1/20 0.46
MAPK8 P45983 1/20 0.45
MAPK9 P45984 1/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
LMNA P02545 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PRMT5 O14744 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
ADORA2B P29275 1/20 0.42
MAPK1 P28482 1/20 0.42
MAPT P10636 1/20 0.42
EGFR P00533 1/20 0.42
ACLY P53396 1/20 0.42

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
SCHEMBL30160665 0.83 MAPK1 (0.53) GAATSHRPOLBMEN1KMT2A
SCHEMBL28513461 0.83 MAPK1 (0.53) GAATSHRPOLBMEN1KMT2A
SCHEMBL28512866 0.82 TSHR (0.46) MAT2ATSHRPOLBMEN1KMT2A
SCHEMBL28518164 0.82 TSHR (0.52) GAATSHRPOLBMEN1KMT2A
SCHEMBL28513463 0.79 MAT2A (0.47) MAT2ATSHRPOLBLMNAMAPK1
SCHEMBL28520871 0.79 LMNA (0.49) TSHRPOLBMEN1KMT2ALMNA
SCHEMBL28512956 0.78 CYP19A1 (0.53) GAAPOLBMEN1KMT2ALMNA
SCHEMBL28507326 0.76 GAA (0.44) GAAMAT2ATSHRPOLBMEN1
SCHEMBL28519950 0.73 TSHR (0.52) GAATSHRPOLBLMNASMN1; SMN2
SCHEMBL28509792 0.73 TSHR (0.46) GAATSHRPOLBMEN1KMT2A

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
CN-110105359-B Method for synthesizing indene spiro isoindole [2,1-b ] isoquinoline triketone compound 河南师范大学 2021-08-03 CN disclosed
CN-108997339-B Method for synthesizing isoindole [2,1-b ] isoquinoline-7-carboxylic ester compound 河南师范大学 2021-01-29 CN disclosed