SCHEMBL30656765

SCHEMBL30656765

NC(=O)[C@H]1CCN(c2ccc(Cl)c(F)c2)C1

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 17/20 0.59
ALDH1A1 P00352 1/20 0.46
HSP90AA1 P07900 1/20 0.46

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
SCHEMBL22491869 1.00 NOTUM (0.59) NOTUMALDH1A1HSP90AA1
SCHEMBL22655697 1.00 NOTUM (0.59) NOTUMALDH1A1HSP90AA1
SCHEMBL22655506 0.88 NOTUM (0.77) NOTUM
SCHEMBL30656783 0.88 NOTUM (0.60) NOTUM
SCHEMBL22655664 0.88 NOTUM (0.60) NOTUM
SCHEMBL22491879 0.88 NOTUM (0.60) NOTUM
SCHEMBL22491862 0.88 NOTUM (0.77) NOTUM
SCHEMBL30656717 0.88 NOTUM (0.77) NOTUM
SCHEMBL30263140 0.87 NOTUM (0.76) NOTUMALDH1A1
SCHEMBL31320029 0.83 NOTUM (0.55) NOTUM

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
CN-111417635-B Pyrazolopyrimidines with anti-Respiratory Syncytial Virus (RSV) activity 爱尔兰詹森科学公司 2024-01-02 CN disclosed