SCHEMBL24609148

SCHEMBL24609148

Cc1ncc(C(C)(C)C)cc1NS(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 1/20 0.44
PIK3CA P42336 9/20 0.41
PIK3CD O00329 2/20 0.38
PIK3CB P42338 2/20 0.38
PIK3CG P48736 2/20 0.38
PTGS1 P23219 1/20 0.36
TRPV1 Q8NER1 1/20 0.36
MTOR P42345 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL17996190 0.84 BRD4 (0.40) PIK3C3PIK3CAPTGS1TRPV1KDM4E
SCHEMBL17946826 0.82 PIK3CA (0.57) PIK3C3PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17946250 0.80 PIK3CD (0.50) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL24609150 0.80 SLC22A12 (0.41) PIK3CAPIK3CDPIK3CBPIK3CGTRPV1
SCHEMBL18595671 0.79 CYP17A1 (0.41) PIK3C3PIK3CAKDM4EALDH1A1LMNA
SCHEMBL24576532 0.79 PIK3C3 (0.48) PIK3C3PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17946279 0.76 PIK3CD (0.42) PIK3CAPIK3CDPIK3CBPIK3CGTRPV1
SCHEMBL23362710 0.76 PIK3C3 (0.46) PIK3C3PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL855688 0.76 PIK3C3 (0.46) PIK3C3PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL116876 0.76 PIK3CA (0.48) PIK3C3PIK3CAPIK3CDPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239764-A1 SUBSTITUTED AMINOBENZYL HETEROARYL COMPOUNDS AS EGFR AND/OR PI3K INHIBITORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2024-07-18 US disclosed
US-11673876-B2 Substituted aminobenzyl heteroaryl compounds as EGFR and/or PI3K inhibitors MEKANISTIC THERAPEUTICS LLC (US) 2023-06-13 US disclosed
US-20220213054-A1 SUBSTITUTED AMINOBENZYL HETEROARYL COMPOUNDS AS EGFR AND/OR PI3K INHIBITORS MEKANISTIC THERAPEUTICS LLC (US) 2022-07-07 US 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 (3 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-20240239764-A1 SUBSTITUTED AMINOBENZYL HETEROARYL COMPOUNDS AS EGFR AND/OR PI3K INHIBITORS EGFR, ERBB2, ERBB3 PIK3C3 32/4885PIK3CA 8/4885PIK3CD 22/4885
US-11673876-B2 Substituted aminobenzyl heteroaryl compounds as EGFR and/or PI3K inhibitors EGFR, ERBB2, ERBB3 PIK3C3 32/4885PIK3CA 8/4885PIK3CD 22/4885
US-20220213054-A1 SUBSTITUTED AMINOBENZYL HETEROARYL COMPOUNDS AS EGFR AND/OR PI3K INHIBITORS EGFR, ERBB2, ERBB3 PIK3C3 32/4885PIK3CA 8/4885PIK3CD 22/4885

“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.