SCHEMBL29923006

SCHEMBL29923006

COc1ncc(-c2ccc3nc(N)n(-c4ccc(N5CCOCC5)cc4)c3c2)cc1S(=O)(=O)Nc1ccccc1F

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 17/20 0.61
PIK3CG P48736 16/20 0.61
PIK3CA P42336 2/20 0.51
PIK3CD O00329 2/20 0.48
PIK3R1 P27986 1/20 0.46
PIK3CB P42338 1/20 0.46

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
SCHEMBL14247403 1.00 PI4KA (0.61) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1
SCHEMBL30089076 1.00 PI4KA (0.61) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1
SCHEMBL14317917 0.93 PIK3CG (0.67) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1
SCHEMBL14247728 0.92 PI4KA (0.55) PI4KAPIK3CGPIK3CAPIK3CD
SCHEMBL14247335 0.92 PI4KA (0.56) PI4KAPIK3CGPIK3CAPIK3CD
SCHEMBL9960577 0.91 PI4KA (0.74) PI4KAPIK3CG
SCHEMBL14247481 0.91 PI4KA (0.55) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1
SCHEMBL14247306 0.90 PIK3CG (0.54) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1
Formic Acid SCHEMBL14247532 0.90 PIK3CG (0.63) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1
SCHEMBL14247284 0.88 PIK3CG (0.54) PI4KAPIK3CGPIK3CAPIK3CDPIK3R1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4059948-A1 LIBRARY OF BARCODED EXTRACELLULAR VESICLES The University of Tokyo (JP) 2022-09-21 EP claimed
US-20240391942-A1 HALOGENATED PHENYLARSINE OXIDE COMPOUND AND APPLICATION THEREOF NUO-BETA PHARMACEUTICAL TECHNOLOGY (SHANGHAI) CO., LTD. (CN) 2024-11-28 US disclosed
CN-118103380-A Halogenated benzene arsenic oxide compound and application thereof 挪贝肽医药科技(上海)有限公司 2024-05-28 CN disclosed
US-20220411785-A1 LIBRARY OF BARCODED EXTRACELLULAR VESICLES THE UNIVERSITY OF TOKYO (JP) 2022-12-29 US disclosed
EP-4059948-A1 LIBRARY OF BARCODED EXTRACELLULAR VESICLES The University of Tokyo (JP) 2022-09-21 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240391942-A1 HALOGENATED PHENYLARSINE OXIDE COMPOUND AND APPLICATION THEREOF SLCO2B1, SLCO2A1, SLCO1B1 PI4KA 3755/4885PIK3CG 4211/4885PIK3CA 3093/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.