SCHEMBL27085865

SCHEMBL27085865

O=C1NCc2c(Br)cc(CO)cc21

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIM1 P11309 2/20 0.49
▸ ROCK1 Q13464 2/20 0.49
▸ CLK4 Q9HAZ1 2/20 0.49
▸ CSNK1A1 P48729 1/20 0.49
▸ CDK5 Q00535 1/20 0.49
▸ DYRK1A Q13627 1/20 0.49
▸ LRRK2 Q5S007 1/20 0.49
▸ DYRK1B Q9Y463 1/20 0.49
▸ GRM2 Q14416 1/20 0.37
▸ KDR P35968 6/20 0.35
▸ KDM4E B2RXH2 1/20 0.33
▸ CASP6 P55212 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ PIK3CD O00329 4/20 0.33
▸ PIK3CB P42338 4/20 0.33
▸ PIK3CA P42336 3/20 0.33
▸ PLK4 O00444 1/20 0.33
▸ AURKA O14965 1/20 0.33
▸ ROCK2 O75116 1/20 0.33
▸ PRKD3 O94806 1/20 0.33

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
SCHEMBL31458870 0.87 CDK5 (0.49) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL22981764 0.84 PARP10 (0.51) PARP10PARP11
SCHEMBL29698267 0.84 PARP10 (0.51) PARP10PARP11
SCHEMBL27085852 0.81 GRM2 (0.44) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL32686624 0.80 CLK1 (0.38) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL1334392 0.77 CLK4 (0.53) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL29841781 0.76 HTR2A (0.38) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL29089792 0.76 GRM2 (0.40) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL21200175 0.76 HTR2A (0.38) PIM1ROCK1CLK4CSNK1A1CDK5
SCHEMBL32686358 0.76 GRM2 (0.35) PIM1ROCK1CLK4CSNK1A1CDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117858707-A CBL-B modulators and uses thereof 林伯士克莱奥公司 2024-04-09 — — CN disclosed
EP-4319756-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-02-14 — — EP disclosed
WO-2022217276-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-10-13 — — WO disclosed
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