SCHEMBL31035490

SCHEMBL31035490

Cc1cc([C@@H](C)Nc2cccnc2-c2cc(Cl)c(B3OC(C)(C)C(C)(C)O3)c(C=O)c2)c2oc(N3CCC(C)(C)CC3)c(C)c(=O)c2c1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.53
AKT2 P31751 1/20 0.53
AKT3 Q9Y243 1/20 0.53
PIK3CA P42336 18/20 0.48
PIK3CB P42338 1/20 0.38

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
SCHEMBL31035140 0.96 AKT1 (0.47) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL31035215 0.93 AKT1 (0.53) AKT1AKT2AKT3PIK3CA
SCHEMBL31035451 0.91 PIK3CA (0.57) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL31035711 0.89 AKT1 (0.55) AKT1AKT2AKT3PIK3CA
SCHEMBL31035234 0.89 AKT1 (0.58) AKT1AKT2AKT3PIK3CA
SCHEMBL31035463 0.88 AKT1 (0.47) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL31035328 0.87 AKT1 (0.46) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL31035809 0.86 PIK3CA (0.54) AKT1AKT2AKT3PIK3CAPIK3CB
SCHEMBL31035059 0.85 AKT1 (0.61) AKT1AKT2AKT3PIK3CA
SCHEMBL31035000 0.85 AKT1 (0.61) AKT1AKT2AKT3PIK3CA

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-4680612-A1 CHEMICAL COMPOUNDS AN2 Therapeutics, Inc. (US) 2026-01-21 EP disclosed
WO-2024192309-A1 CHEMICAL COMPOUNDS REACTIVE BIOSCIENCES, INC. (US) 2024-09-19 WO disclosed