SCHEMBL31456643

SCHEMBL31456643

Cc1nc(Cl)ncc1OC(F)F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.36
KDM4E B2RXH2 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GRIN1 Q05586 9/20 0.33
GRIN2B Q13224 9/20 0.33
RXRA P19793 8/20 0.33
JUN P05412 2/20 0.33
NFKB1 P19838 2/20 0.33
NFKB2 Q00653 2/20 0.33
RELA Q04206 2/20 0.33
GAA P10253 1/20 0.32
F2RL3 Q96RI0 1/20 0.32
XPO1 O14980 1/20 0.32
KCNH2 Q12809 2/20 0.31
CSNK1A1 P48729 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL24978005 0.81 LRRK2 (0.35) LRRK2KDM4EALDH1A1SMN1; SMN2JUN
SCHEMBL26627777 0.78 CSNK1A1 (0.46) LRRK2KDM4EALDH1A1SMN1; SMN2GRIN1
SCHEMBL30462039 0.78 CSNK1A1 (0.46) LRRK2KDM4EALDH1A1SMN1; SMN2GRIN1
SCHEMBL31456685 0.77 LRRK2 (0.34) LRRK2KDM4EALDH1A1SMN1; SMN2GRIN1
SCHEMBL29796850 0.76 ALDH1A1 (0.53) KDM4EALDH1A1SMN1; SMN2JUNNFKB1
SCHEMBL121368 0.76 ALDH1A1 (0.53) KDM4EALDH1A1SMN1; SMN2JUNNFKB1
SCHEMBL24978008 0.74 LRRK2 (0.36) LRRK2KDM4EALDH1A1SMN1; SMN2CSNK1A1
SCHEMBL31214417 0.72 JUN (0.36) KDM4EALDH1A1SMN1; SMN2JUNNFKB1
SCHEMBL19501788 0.70 CSNK1A1 (0.38) KDM4EALDH1A1SMN1; SMN2JUNNFKB1
SCHEMBL20642463 0.70 ALDH1A1 (0.36) LRRK2ALDH1A1GRIN1GRIN2BRXRA

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-119998271-A Pyridone compound and preparation method and application thereof 深圳信立泰药业股份有限公司 2025-05-13 CN disclosed
WO-2025067126-A1 PYRIDONE COMPOUNDS AND PREPARATION METHOD THEREFOR, AND APPLICATION 深圳信立泰药业股份有限公司 2025-04-03 WO disclosed