SCHEMBL29047644

SCHEMBL29047644

Cn1nc(C(F)(F)F)cc1NC(=O)c1ccccc1Nc1cccc(F)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 7/20 0.53
DAPK3 O43293 2/20 0.43
PRKD3 O94806 2/20 0.43
PIM1 P11309 2/20 0.43
CDK2 P24941 2/20 0.43
FLT3 P36888 2/20 0.43
CSNK1A1 P48729 2/20 0.43
GSK3B P49841 2/20 0.43
CDK9 P50750 2/20 0.43
JAK3 P52333 2/20 0.43
CDK5 Q00535 2/20 0.43
MAP4K2 Q12851 2/20 0.43
DYRK1A Q13627 2/20 0.43
MELK Q14680 2/20 0.43
HIPK2 Q9H2X6 2/20 0.43
CLK4 Q9HAZ1 2/20 0.43
STK17A Q9UEE5 2/20 0.43
CDC7 O00311 1/20 0.43
CDK7 P50613 1/20 0.43
PRKX P51817 1/20 0.43

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
SCHEMBL30546985 1.00 RXFP1 (0.53) RXFP1DAPK3PRKD3PIM1CDK2
SCHEMBL30546936 0.92 RXFP1 (0.46) RXFP1FLT3KMT2AMEN1
SCHEMBL29047707 0.92 RXFP1 (0.46) RXFP1FLT3KMT2AMEN1
SCHEMBL29047658 0.90 RXFP1 (0.57) RXFP1KMT2AMAPK14MAPTMEN1
SCHEMBL30546927 0.90 RXFP1 (0.57) RXFP1KMT2AMAPK14MAPTMEN1
SCHEMBL29047630 0.90 RXFP1 (0.68) RXFP1YAP1TEAD4TEAD2
SCHEMBL30546965 0.90 RXFP1 (0.53) RXFP1SLC10A2SLC10A1SLC10A6KMT2A
SCHEMBL29047690 0.90 RXFP1 (0.53) RXFP1SLC10A2SLC10A1SLC10A6KMT2A
SCHEMBL29047582 0.89 RXFP1 (0.48) RXFP1FLT3KMT2AAURKAAURKB
SCHEMBL30546978 0.89 RXFP1 (0.48) RXFP1FLT3KMT2AAURKAAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116535357-A Arylamino benzamide derivative containing substituted pyrazole structure, preparation method and application 西北农林科技大学 2023-08-04 CN disclosed