SCHEMBL31284133

SCHEMBL31284133

C[C@@H](Nc1ccc(Cl)nc1C(=O)O)c1cccc2c(=O)c3c(oc12)-c1ccccc1CC3

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 15/20 0.52
▸ AKT1 P31749 1/20 0.36
▸ AKT2 P31751 1/20 0.36
▸ AKT3 Q9Y243 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ PIK3CB P42338 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ PRKDC P78527 1/20 0.33
▸ PIK3C3 Q8NEB9 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 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
SCHEMBL31144994 0.80 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL31145034 0.80 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3PIK3CB
SCHEMBL31284922 0.78 PIK3CA (0.48) PIK3CAAKT1AKT2AKT3
SCHEMBL31284130 0.73 BCHE (0.34) KDM4EALDH1A1MEN1KMT2ANPC1
SCHEMBL24913052 0.71 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3
SCHEMBL24913106 0.71 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3
SCHEMBL30216401 0.71 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3
SCHEMBL30742473 0.71 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3
SCHEMBL27127007 0.71 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3
SCHEMBL26888376 0.71 PIK3CA (0.63) PIK3CAAKT1AKT2AKT3

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-4731626-A1 PI3K INHIBITORS AND USE THEREOF Regor Pharmaceuticals, Inc. (US) 2026-04-29 — — EP disclosed
WO-2024260464-A1 PI3K INHIBITORS AND USE THEREOF REGOR PHARMACEUTICALS, INC. (US) 2024-12-26 — — WO disclosed
Send feedback