SCHEMBL31444285

SCHEMBL31444285

NS(=O)(=O)c1ccc(Nc2ncc(C(F)(F)F)c(Cl)n2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 4/20 0.50
CA2 P00918 10/20 0.47
CA1 P00915 9/20 0.47
CA9 Q16790 2/20 0.46
CDK1 P06493 1/20 0.44
AURKA O14965 1/20 0.43
AURKB Q96GD4 1/20 0.43
SOS1 Q07889 1/20 0.41
PTK2 Q05397 1/20 0.41
TRPV1 Q8NER1 1/20 0.41

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
SCHEMBL29631628 0.84 LRRK2 (0.48) LRRK2PTK2TRPV1
SCHEMBL5567494 0.82 CDK1 (0.58) CA2CA1CA9CDK1AURKA
SCHEMBL31121916 0.76 CCNE1 (0.46) LRRK2CDK1
SCHEMBL9275713 0.75 CNR2 (0.40) LRRK2PTK2TRPV1
SCHEMBL30291146 0.74 JAK2 (0.49) LRRK2CDK1
SCHEMBL30291355 0.74 CCNE1 (0.55) LRRK2CDK1
SCHEMBL30291345 0.74 LRRK2 (0.51) LRRK2CDK1
SCHEMBL30291237 0.74 CCNE1 (0.44) LRRK2CA2CA1CDK1PTK2
SCHEMBL30291198 0.74 JAK2 (0.49) LRRK2CDK1
SCHEMBL30291140 0.74 JAK2 (0.49) LRRK2CDK1

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-4532473-A1 AMINOHETEROARYL KINASE INHIBITORS Allorion Therapeutics Inc. (US) 2025-04-09 EP disclosed
CN-119343333-A Amino heteroaryl kinase inhibitors 安锐生物医药公司 2025-01-21 CN disclosed