SCHEMBL30219237

SCHEMBL30219237

COc1cc(Br)c(N)cc1Nc1nccc(-c2cn(C)c3ccccc23)n1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK2 Q9HBH9 5/20 0.70
MKNK1 Q9BUB5 4/20 0.70
EGFR P00533 14/20 0.63
HDAC1 Q13547 3/20 0.58
HDAC3 O15379 2/20 0.58
HDAC4 P56524 2/20 0.58
HDAC7 Q8WUI4 2/20 0.58
HDAC2 Q92769 2/20 0.58
HDAC10 Q969S8 2/20 0.58
HDAC11 Q96DB2 2/20 0.58
HDAC8 Q9BY41 2/20 0.58
HDAC6 Q9UBN7 2/20 0.58
HDAC9 Q9UKV0 2/20 0.58
HDAC5 Q9UQL6 2/20 0.58
MLNR O43193 1/20 0.55
KDM1A O60341 1/20 0.55
ABCB11 O95342 1/20 0.55
ERBB2 P04626 1/20 0.55
INSR P06213 1/20 0.55
CHRM2 P08172 1/20 0.55

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
SCHEMBL14661053 1.00 MKNK2 (0.70) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL18870128 0.92 MKNK2 (0.75) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL17822329 0.92 MKNK2 (0.74) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL29525375 0.92 MKNK2 (0.74) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL29555776 0.89 MKNK2 (0.70) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL21729615 0.89 MKNK2 (0.70) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL19209723 0.89 MKNK2 (0.73) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL31366682 0.89 MKNK2 (0.70) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL28646132 0.86 MKNK2 (0.67) MKNK2MKNK1EGFRHDAC1HDAC3
SCHEMBL19336993 0.86 MKNK2 (0.66) MKNK2MKNK1EGFRHDAC1HDAC3

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
EP-4119551-A1 2-(2,4,5-SUBSTITUTED-ANILINO)PYRIMIDINE COMPOUNDS Astrazeneca AB (SE) 2023-01-18 EP disclosed