SCHEMBL5337139

SCHEMBL5337139

C[C@@H]1Oc2ccc(/C=C3/SC(=S)NC3=O)cc2N(Cc2ccccc2)C1=O

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 17/20 0.70
NPC1 O15118 1/20 0.54
CASP3 P42574 1/20 0.54
RAB9A P51151 1/20 0.54
SENP8 Q96LD8 1/20 0.54
SENP7 Q9BQF6 1/20 0.54
SENP6 Q9GZR1 1/20 0.54
PIK3C2A O00443 2/20 0.54
PIK3C2B O00750 2/20 0.54
PIK3CA P42336 2/20 0.54
PRKDC P78527 2/20 0.54
PIK3R1 P27986 1/20 0.54
PIK3C3 Q8NEB9 1/20 0.54
PIK3CD O00329 1/20 0.54
PIK3CB P42338 1/20 0.54
ADAMTS5 Q9UNA0 1/20 0.51

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
SCHEMBL5337148 1.00 PIK3CG (0.70) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5337144 1.00 PIK3CG (0.70) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5345470 0.90 PIK3CG (0.57) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5345471 0.90 PIK3CG (0.57) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5341931 0.89 PIK3CG (0.56) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5341926 0.89 PIK3CG (0.56) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5345969 0.88 PIK3CG (0.62) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5345973 0.88 PIK3CG (0.62) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5345972 0.88 PIK3CG (0.62) PIK3CGNPC1CASP3RAB9ASENP8
SCHEMBL5345814 0.83 PIK3CG (0.72) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7205295-B2 Benzoxazin-3-ones and derivatives thereof as therapeutic agents WARNER-LAMBERT COMPANY LLC (US) 2007-04-17 US disclosed
EP-1569653-A1 BENZOXAZIN-3-ONES AND DERIVATIVES THEREOF AS INHIBITORS OF PI3K Warner-Lambert Company LLC (US) 2005-09-07 EP disclosed
WO-2004052373-A1 BENZOXAZIN-3-ONES AND DERIVATIVES THEREOF AS INHIBITORS OF PI3K WARNER-LAMBERT COMPANY LLC (US) 2004-06-24 WO 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 (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-20040121996-A1 Benzoxazin-3-ones and derivatives thereof as therapeutic agents XDH, HAX1, CYP4X1 PIK3CG 4186/4885NPC1 4038/4885CASP3 326/4885

“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.