SCHEMBL29612152

SCHEMBL29612152

O=C(O)c1[nH]c2ccccc2c1F

nearest known ligand 0.61

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.61
ALDH1A1 P00352 3/20 0.61
HPGD P15428 2/20 0.61
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
POLB P06746 1/20 0.56
EIF4A3 P38919 1/20 0.55
FOLH1 Q04609 1/20 0.54
GFER P55789 2/20 0.51
CNR2 P34972 1/20 0.51
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
HSD17B10 Q99714 1/20 0.49
MAP2 P11137 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
MCL1 Q07820 1/20 0.48

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
SCHEMBL1144926 1.00 KDM4E (0.61) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL30310610 0.83 MAP2 (0.60) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL697252 0.79 MAPT (0.59) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL29897041 0.78 ALDH1A1 (0.63) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL30366683 0.78 KDM4E (0.62) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL62193 0.78 KDM4E (0.62) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL2399274 0.78 ALDH1A1 (0.63) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL87871 0.78 KDM4E (0.65) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL2490053 0.78 EIF4A3 (0.65) KDM4EALDH1A1HPGDMEN1KMT2A
SCHEMBL2813085 0.77 KDM4E (0.61) KDM4EALDH1A1HPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114380732-B Preparation method of fluoroindole carboxylic acid compound 上海毕得医药科技股份有限公司 2024-01-23 CN claimed
CN-114380732-A Preparation method of fluoro-indole carboxylic acid compounds 上海毕得医药科技股份有限公司 2022-04-22 CN claimed
CN-114380732-B Preparation method of fluoroindole carboxylic acid compound 上海毕得医药科技股份有限公司 2024-01-23 CN disclosed
CN-114380732-B Preparation method of fluoroindole carboxylic acid compound 上海毕得医药科技股份有限公司 2024-01-23 CN disclosed
CN-114380732-B Preparation method of fluoroindole carboxylic acid compound 上海毕得医药科技股份有限公司 2024-01-23 CN disclosed
CN-114380732-A Preparation method of fluoro-indole carboxylic acid compounds 上海毕得医药科技股份有限公司 2022-04-22 CN disclosed
CN-114380732-A Preparation method of fluoro-indole carboxylic acid compounds 上海毕得医药科技股份有限公司 2022-04-22 CN disclosed
CN-114380732-A Preparation method of fluoro-indole carboxylic acid compounds 上海毕得医药科技股份有限公司 2022-04-22 CN disclosed