SCHEMBL29033141

SCHEMBL29033141

O=c1[nH]nc(C2CC2F)c2cc(Br)ccc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 3/20 0.40
▸ WDR77 Q9BQA1 3/20 0.40
▸ PIM1 P11309 5/20 0.38
▸ DYRK1A Q13627 4/20 0.38
▸ JAK2 O60674 3/20 0.38
▸ CHEK1 O14757 3/20 0.38
▸ FLT3 P36888 3/20 0.38
▸ PRKD3 O94806 2/20 0.38
▸ MAP4K4 O95819 2/20 0.38
▸ CSF1R P07333 2/20 0.38
▸ CLK2 P49760 2/20 0.38
▸ MAP4K2 Q12851 2/20 0.38
▸ NTRK3 Q16288 2/20 0.38
▸ AURKB Q96GD4 2/20 0.38
▸ CLK4 Q9HAZ1 2/20 0.38
▸ METAP2 P50579 1/20 0.38
▸ AURKA O14965 1/20 0.38
▸ DAPK3 O43293 1/20 0.38
▸ PAK4 O96013 1/20 0.38
▸ ABL1 P00519 1/20 0.38

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
SCHEMBL26733229 1.00 PRMT5 (0.40) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL29426504 0.81 PRMT5 (0.42) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL24076263 0.81 PRMT5 (0.42) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL26049203 0.77 PRMT5 (0.38) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL26049201 0.77 PRMT5 (0.38) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL17824559 0.75 PRMT5 (0.45) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL30984977 0.73 PRMT5 (0.46) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL25141683 0.73 PRMT5 (0.46) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL24076903 0.73 PRMT5 (0.48) PRMT5WDR77PIM1DYRK1AJAK2
SCHEMBL17824774 0.72 PRMT5 (0.46) PRMT5WDR77PIM1DYRK1AJAK2

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-116261456-A Compounds, compositions, and methods 戴纳立制药公司 2023-06-13 — — CN disclosed
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