SCHEMBL30468366

SCHEMBL30468366

COc1ncc(-c2ccc3nc(NC(C)=O)cn3n2)cc1C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.69
RIPK1 Q13546 19/20 0.68

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
SCHEMBL22371135 1.00 PIK3CA (0.69) PIK3CARIPK1
Hydrochloric Acid SCHEMBL22371096 0.99 PIK3CA (0.68) PIK3CARIPK1
SCHEMBL22371164 0.93 PIK3CA (0.68) PIK3CARIPK1
SCHEMBL30468380 0.93 PIK3CA (0.68) PIK3CARIPK1
SCHEMBL30468189 0.92 PIK3CA (0.69) PIK3CARIPK1
Lithium Ion SCHEMBL29849374 0.91 PIK3CA (0.66) PIK3CARIPK1
SCHEMBL22370955 0.89 RIPK1 (0.66) RIPK1
SCHEMBL22371171 0.89 RIPK1 (0.67) RIPK1
SCHEMBL2920182 0.89 PIK3CA (0.80) PIK3CARIPK1
SCHEMBL22371256 0.88 RIPK1 (0.65) PIK3CARIPK1

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-111566103-B Aminoimidazopyrazines as kinase inhibitors 百时美施贵宝公司 2023-06-23 CN disclosed