SCHEMBL30598935

SCHEMBL30598935

O=Cc1cc(Br)c2c(c1)C(=O)NC2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK5 Q00535 2/20 0.50
▸ DYRK1A Q13627 2/20 0.50
▸ CLK4 Q9HAZ1 2/20 0.50
▸ PIM1 P11309 1/20 0.50
▸ CSNK1A1 P48729 1/20 0.50
▸ ROCK1 Q13464 1/20 0.50
▸ LRRK2 Q5S007 1/20 0.50
▸ DYRK1B Q9Y463 1/20 0.50
▸ GRM2 Q14416 1/20 0.35
▸ PARP10 Q53GL7 3/20 0.33
▸ PARP11 Q9NR21 2/20 0.33
▸ CISD1 Q9NZ45 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CA12 O43570 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ JAK3 P52333 1/20 0.31
▸ LTK P29376 1/20 0.31
▸ MST1R Q04912 1/20 0.31

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
SCHEMBL25415363 1.00 CDK5 (0.50) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL25413193 0.85 CDK5 (0.49) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL30004086 0.81 GRM2 (0.42) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL27086356 0.81 GRM2 (0.42) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL32686478 0.79 ALDH1A1 (0.37) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL29920437 0.76 ALDH1A1 (0.42) PIM1KMT2APIK3CDPIK3CBPIK3CA
SCHEMBL21200740 0.76 GRM2 (0.35) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL30605858 0.76 GRM2 (0.38) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL30598890 0.76 GRM2 (0.35) CDK5DYRK1ACLK4PIM1CSNK1A1
SCHEMBL27085830 0.76 ALDH1A1 (0.42) PIM1KMT2APIK3CDPIK3CBPIK3CA

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
EP-4490152-A1 ACTIVATORS OF EFFECTOR T CELLS Orum Therapeutics Inc. (KR) 2025-01-15 — — EP disclosed
WO-2023170608-A1 ACTIVATORS OF EFFECTOR T CELLS ORUM THERAPEUTICS, INC. (KR) 2023-09-14 — — WO disclosed
Send feedback