SCHEMBL24005850

SCHEMBL24005850

Nc1cnc2[nH]cc(Cl)c2c1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.42
WDR77 Q9BQA1 1/20 0.42
BTK Q06187 7/20 0.40
ITK Q08881 7/20 0.40
KIT P10721 2/20 0.40
KLKB1 P03952 1/20 0.40
MAP4K1 Q92918 1/20 0.40
NTRK1 P04629 4/20 0.40
GSK3B P49841 1/20 0.40
JAK2 O60674 1/20 0.39
MAP3K11 Q16584 1/20 0.39
BACE1 P56817 1/20 0.38
KCNH2 Q12809 1/20 0.38
CLK1 P49759 1/20 0.38
DYRK1A Q13627 1/20 0.38
DYRK2 Q92630 1/20 0.38
DYRK1B Q9Y463 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
SCHEMBL20033884 0.77 BTK (0.39) PRMT5WDR77BTKITKNTRK1
SCHEMBL1564760 0.77 ITK (0.54) PRMT5WDR77BTKITKNTRK1
SCHEMBL91445 0.77 AXL (0.41) PRMT5WDR77BTKITKJAK2
SCHEMBL23030509 0.77 BTK (0.39) PRMT5WDR77BTKITKNTRK1
SCHEMBL10269012 0.77 MET (0.43) PRMT5WDR77BTKITKKIT
SCHEMBL25971496 0.77 BRD4 (0.47) KITNTRK1GSK3BMAP3K11CLK1
SCHEMBL7443703 0.77 PRMT5 (0.48) PRMT5WDR77BTKITKKLKB1
SCHEMBL29481417 0.77 PRMT5 (0.48) PRMT5WDR77BTKITKKLKB1
SCHEMBL16186620 0.76 KIT (0.72) BTKITKKITNTRK1GSK3B
Hydrochloric Acid SCHEMBL7213801 0.75 PRMT5 (0.47) PRMT5WDR77BTKITKKLKB1

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
WO-2021223736-A1 COMPOUNDS AS BCL-2 INHIBITORS FOCHON PHARMACEUTICALS, LTD. (CN) 2021-11-11 WO disclosed