SCHEMBL28978830

SCHEMBL28978830

N#Cc1c(Cl)c2ncc(C(F)(F)F)cc2n(-c2ccccc2)c1=O

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 2/20 0.43
▸ ALDH1A1 P00352 4/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ USP14 P54578 2/20 0.40
▸ KMT2A Q03164 1/20 0.37
▸ MAT2A P31153 1/20 0.36
▸ RECQL P46063 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HTT P42858 1/20 0.36
▸ GLA P06280 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ GAA P10253 3/20 0.35
▸ TDP2 O95551 1/20 0.35
▸ PIK3CD O00329 1/20 0.35
▸ PIK3R1 P27986 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
SCHEMBL29417517 0.87 CTSK (0.43) CTSKALDH1A1KDM4EUSP14KMT2A
SCHEMBL28978596 0.87 CTSK (0.43) CTSKALDH1A1KDM4EUSP14KMT2A
SCHEMBL30358964 0.81 MAT2A (0.48) CTSKALDH1A1KDM4EKMT2AMAT2A
SCHEMBL28978826 0.81 MAT2A (0.48) CTSKALDH1A1KDM4EKMT2AMAT2A
SCHEMBL28978580 0.78 MAT2A (0.41) CTSKALDH1A1KDM4EKMT2AMAT2A
SCHEMBL29417542 0.71 MAT2A (0.48) CTSKALDH1A1KDM4EKMT2AMAT2A
SCHEMBL30608124 0.71 MAT2A (0.48) CTSKALDH1A1KDM4EMAT2ALMNA
SCHEMBL26125895 0.71 MAT2A (0.48) CTSKALDH1A1KDM4EMAT2ALMNA
SCHEMBL28978808 0.71 MAT2A (0.48) CTSKALDH1A1KDM4EKMT2AMAT2A
SCHEMBL8178799 0.70 KDM4E (0.46) ALDH1A1KDM4EKMT2ALMNAGLA

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-115916778-A Methionine adenosyltransferase inhibitor, preparation method and application thereof 赛诺哈勃药业(成都)有限公司 2023-04-04 — — CN disclosed
WO-2022053022-A1 METHIONINE ADENOSYLTRANSFERASE INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 赛诺哈勃药业(成都)有限公司 2022-03-17 — — WO disclosed
Send feedback