SCHEMBL28038684

SCHEMBL28038684

CC(OC=O)n1ccc2cc(Cl)ncc21

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CB P42338 1/20 0.31
CCR9 P51686 1/20 0.31
CDC7 O00311 1/20 0.31
CDK2 P24941 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
SCHEMBL27658730 0.84 PIK3CB (0.31) PIK3CB
SCHEMBL28760271 0.81
SCHEMBL2226803 0.79 PIK3CB (0.38) PIK3CBCCR9CDC7CDK2
SCHEMBL27647386 0.76 RAPGEF4 (0.37) CDC7CDK2
SCHEMBL27554375 0.73
SCHEMBL27637862 0.73 RAPGEF4 (0.37) CDC7CDK2
SCHEMBL27729177 0.73 IRAK4 (0.33)
SCHEMBL28774139 0.70 KMT2A (0.33)
SCHEMBL15548780 0.68 PIK3CB (0.62) PIK3CBCCR9CDC7CDK2
SCHEMBL30633547 0.68 PIK3CB (0.62) PIK3CBCCR9CDC7CDK2

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-105392787-A Aza-oxo-indoles for the treatment and prophylaxis of respiratory syncytial virus infection HOFFMANN LA ROCHE 2016-03-09 CN disclosed