SCHEMBL5339477

SCHEMBL5339477

O=C1NC(=O)/C(=C/c2ccc3c(c2)N(Cc2ccccc2)C(=O)CO3)S1

nearest known ligand 0.83

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 19/20 0.83
PIK3C2A O00443 2/20 0.62
PIK3C2B O00750 2/20 0.62
PIK3CA P42336 2/20 0.62
PRKDC P78527 2/20 0.62
PIK3R1 P27986 1/20 0.62
PIK3C3 Q8NEB9 1/20 0.62
PIK3CD O00329 1/20 0.62
PIK3CB P42338 1/20 0.62

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
SCHEMBL2877647 1.00 PIK3CG (0.83) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5343611 0.91 PIK3CG (0.70) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5343609 0.91 PIK3CG (0.70) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5335927 0.91 PIK3CG (1.00) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5335930 0.91 PIK3CG (1.00) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5343844 0.90 PIK3CG (0.68) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5343840 0.90 PIK3CG (0.68) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5335850 0.88 PIK3CG (0.71) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5343532 0.88 PIK3CG (0.67) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC
SCHEMBL5343531 0.88 PIK3CG (0.67) PIK3CGPIK3C2APIK3C2BPIK3CAPRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-7846925-B2 Azolidinone-vinyl fused-benzene derivatives MERCK SERONO SA (CH) 2010-12-07 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES LABORATOIRES SERONO S.A. (CH) 2009-12-10 US disclosed
US-7205295-B2 Benzoxazin-3-ones and derivatives thereof as therapeutic agents WARNER-LAMBERT COMPANY LLC (US) 2007-04-17 US disclosed
US-20040121996-A1 Benzoxazin-3-ones and derivatives thereof as therapeutic agents BARVIAN NICOLE (US) 2004-06-24 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 (2 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-20090306069-A1 AZOLIDINONE-VINYL FUSED-BENZENE DERIVATIVES ZAP70, BRCA1, ZYX PIK3CG 1265/4885PIK3C2A 1376/4885PIK3C2B 944/4885
US-20040121996-A1 Benzoxazin-3-ones and derivatives thereof as therapeutic agents XDH, HAX1, CYP4X1 PIK3CG 4186/4885PIK3C2A 4721/4885PIK3C2B 4743/4885

“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.