SCHEMBL28935767

SCHEMBL28935767

Cc1ccc2c(-c3ccc(Nc4cc5c(cn4)CCN(C)CC5)c4c3CN(C(=O)OC(C)(C)C)C4=O)cnn2c1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 2/20 0.34
PRKDC P78527 2/20 0.34
MTOR P42345 1/20 0.34
TTK P33981 10/20 0.34
RET P07949 8/20 0.33
CCNA2 P20248 3/20 0.33
CDK2 P24941 3/20 0.33
AURKA O14965 2/20 0.33

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
SCHEMBL31484050 1.00 PIK3CA (0.34) PIK3CAPRKDCMTORTTKRET
SCHEMBL29878424 0.85 PIK3CA (0.34) PIK3CAPRKDCMTORTTKRET
SCHEMBL29879004 0.85 PIK3CA (0.33) PIK3CAPRKDCMTORTTKRET
SCHEMBL29878089 0.84 TTK (0.36) PIK3CAPRKDCMTORTTKRET
SCHEMBL31484164 0.83 MAPT (0.35) PIK3CAPRKDCMTORRET
SCHEMBL28935785 0.83 MAPT (0.35) PIK3CAPRKDCMTORRET
SCHEMBL30207696 0.83 MAPT (0.35) PIK3CAPRKDCMTORRET
SCHEMBL31484030 0.81 TTK (0.33) PIK3CAPRKDCMTORTTKCCNA2
SCHEMBL28935696 0.81 TTK (0.33) PIK3CAPRKDCMTORTTKCCNA2
SCHEMBL31484108 0.81

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-115611925-A HPK1 inhibitors and uses thereof 轩竹生物科技股份有限公司 2023-01-17 CN disclosed