SCHEMBL27166404

SCHEMBL27166404

Cc1ccccc1Nc1ncc2cc(Cl)c(=O)n(C(C)C)c2n1.O=S(=O)(Cl)Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
WEE1 P30291 6/20 0.47
LRRK2 Q5S007 1/20 0.46
CCND3 P30281 3/20 0.46
CDK4 P11802 1/20 0.46
CCND1 P24385 1/20 0.46
CCND2 P30279 1/20 0.46
FGFR1 P11362 4/20 0.44
EGFR P00533 3/20 0.44
PTK2 Q05397 1/20 0.42
SRC P12931 3/20 0.41
FGFR4 P22455 2/20 0.41
FGFR2 P21802 1/20 0.41
FGFR3 P22607 1/20 0.41
CCNA2 P20248 3/20 0.40
CDK2 P24941 3/20 0.40
CCNK O75909 2/20 0.40
CDK9 P50750 2/20 0.40
CDK6 Q00534 2/20 0.40
RIPK2 O43353 2/20 0.40
ACVR1 Q04771 2/20 0.40

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
SCHEMBL29991124 0.87 RIPK2 (0.40) WEE1LRRK2CCND3CDK4CCND1
SCHEMBL25122990 0.87 RIPK2 (0.40) WEE1LRRK2CCND3CDK4CCND1
SCHEMBL25122419 0.85 LRRK2 (0.47) LRRK2CDK2RIPK2ACVR1NOD2
SCHEMBL25122423 0.84 RIPK2 (0.39) WEE1LRRK2CCND3CDK4CCND1
SCHEMBL27360240 0.83 CCNE1 (0.44) WEE1LRRK2CCND3CDK4CCND1
SCHEMBL27359840 0.82 WEE1 (0.37) WEE1CCND3CDK4CCND1CCND2
SCHEMBL27359843 0.82 RIPK2 (0.38) WEE1LRRK2CCND3CDK4CCND1
SCHEMBL27360006 0.82 PTK2 (0.50) LRRK2FGFR1EGFRPTK2SRC
SCHEMBL27361790 0.82 PSEN1 (0.45) WEE1LRRK2CCND3CDK4CCND1
SCHEMBL27359929 0.81 CCND1 (0.38) WEE1LRRK2CCND3CDK4CCND1

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
EP-4334307-A1 CDK2 DEGRADERS AND USES THEREOF Kymera Therapeutics, Inc. (US) 2024-03-13 EP disclosed