SCHEMBL24867265

SCHEMBL24867265

Cc1cnccc1Nc1cnc(NC2CCN(CC(C)C)CC2)nc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 6/20 0.53
▸ ROCK1 Q13464 4/20 0.53
▸ NAMPT P43490 4/20 0.39
▸ PRKD1 Q15139 2/20 0.39
▸ DRD2 P14416 3/20 0.36
▸ DRD3 P35462 3/20 0.36
▸ AOC3 Q16853 1/20 0.35
▸ WNT1 P04628 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ AKT1 P31749 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ POLB P06746 1/20 0.34

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
SCHEMBL24867261 0.85 MAP4K1 (0.42) AOC3POLB
SCHEMBL24867263 0.79 MAPK1 (0.56) AOC3
SCHEMBL24867273 0.79 AOC3 (0.36) AOC3DYRK1A
SCHEMBL24867264 0.79 AOC3 (0.36) AOC3DYRK1A
SCHEMBL24866922 0.78 MAPK1 (0.36) AOC3
SCHEMBL24866931 0.78 AOC3 (0.38) AOC3
SCHEMBL24867267 0.77 DYRK1A (0.41) AOC3DYRK1A
SCHEMBL3312007 0.71 ROCK2 (0.61) ROCK2ROCK1NAMPTPRKD1DYRK1A
SCHEMBL1716536 0.70 ROCK2 (1.00) ROCK2ROCK1
SCHEMBL24866871 0.68 MAPK3 (0.36) POLB

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
WO-2023283488-A9 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CZ BIOHUB SF, LLC (US) 2023-05-25 — — WO disclosed
WO-2023283488-A2 CDK19-SELECTIVE INHIBITORS, AND METHODS OF USE THEREOF CHAN ZUCKERBERG BIOHUB, INC. (US) 2023-01-12 — — WO disclosed
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