SCHEMBL31035207

SCHEMBL31035207

CC(=O)c1cc(C)cc2c(=O)c(C)c(N3CCC4(CC3)CC4)oc12

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 15/20 0.51
AKT1 P31749 1/20 0.49
AKT2 P31751 1/20 0.49
AKT3 Q9Y243 1/20 0.49
P2RY12 Q9H244 1/20 0.36
PDE9A O76083 1/20 0.34
KIF18A Q8NI77 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34

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
SCHEMBL23887230 0.93 AKT1 (0.56) PIK3CAAKT1AKT2AKT3P2RY12
SCHEMBL31035887 0.91 AKT1 (0.50) PIK3CAAKT1AKT2AKT3P2RY12
SCHEMBL31035139 0.88 AKT1 (0.46) PIK3CAAKT1AKT2AKT3P2RY12
SCHEMBL31035072 0.87 P2RY12 (0.48) PIK3CAAKT1AKT2AKT3P2RY12
SCHEMBL23887236 0.83 AKT1 (0.47) PIK3CAAKT1AKT2AKT3
SCHEMBL31035473 0.81 AKT1 (0.48) PIK3CAAKT1AKT2AKT3P2RY12
SCHEMBL31035582 0.81 AKT1 (0.43) PIK3CAAKT1AKT2AKT3P2RY12
SCHEMBL23887318 0.80 PIK3CA (0.60) PIK3CAAKT1AKT2AKT3
SCHEMBL23886891 0.80 AKT1 (0.45) PIK3CAAKT1AKT2AKT3
SCHEMBL23887376 0.80 PIK3CA (0.61) PIK3CAAKT1AKT2AKT3PDE9A

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