SCHEMBL28256129

SCHEMBL28256129

FC(F)(F)c1cccc(Cn2ncc3ccccc32)c1

nearest known ligand 0.63

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.63
GRIN1 Q05586 11/20 0.55
GRIN2B Q13224 11/20 0.55
POLB P06746 1/20 0.49
ABHD6 Q9BV23 1/20 0.48
NPBWR1 P48145 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HTT P42858 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL28254924 0.85 HTT (0.54) RECQLGRIN1GRIN2BPOLBABHD6
SCHEMBL30292357 0.84 RECQL (0.69) RECQLGRIN1GRIN2BNPBWR1
SCHEMBL710816 0.83 GRIN1 (0.48) RECQLGRIN1GRIN2BPOLBABHD6
SCHEMBL30373336 0.81 RECQL (0.69) RECQLGRIN1GRIN2BPOLBHTT
SCHEMBL2330379 0.81 RECQL (0.69) RECQLGRIN1GRIN2BPOLBHTT
SCHEMBL25411542 0.80 PTGER4 (0.52) GRIN1GRIN2BABHD6
SCHEMBL6840436 0.80 EPHX2 (0.54) GRIN1GRIN2B
SCHEMBL30614159 0.80 PTGER4 (0.52) GRIN1GRIN2BABHD6
SCHEMBL9941849 0.80 GRIN1 (0.50) GRIN1GRIN2BPOLBABHD6NPBWR1
SCHEMBL19084655 0.79 HDAC3 (0.47) RECQLGRIN1GRIN2BPOLBHTT

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-109608449-A Compound as type III receptor tyrosine kinase inhibitors 阵列生物制药公司 2019-04-12 CN disclosed
CN-105924437-B Compound as type III receptor tyrosine kinase inhibitors 阵列生物制药公司 2018-11-30 CN disclosed