SCHEMBL17673779

SCHEMBL17673779

Cc1nn(C)c2cc(-c3cc(Nc4ccc5[nH]ncc5c4)nc(N4CCOCC4)n3)ccc12

nearest known ligand 0.68

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 16/20 0.68
▸ PIK3CD O00329 1/20 0.65
▸ PIK3CB P42338 1/20 0.65
▸ PIK3CG P48736 1/20 0.65
▸ ROCK2 O75116 4/20 0.51
▸ ROCK1 Q13464 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
SCHEMBL17677982 0.94 PIK3CA (0.58) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17678010 0.89 PIK3CA (0.51) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17678006 0.86 PIK3CA (0.48) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL20985506 0.86 PIK3CA (0.48) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17677976 0.86 PIK3CA (0.71) PIK3CAPIK3CDPIK3CBPIK3CGROCK2
SCHEMBL17673832 0.86 PIK3CA (0.51) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL18731468 0.85 LMNA (0.58) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17678062 0.85 PTGS2 (0.55) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL18731404 0.84 PIK3CA (0.47) PIK3CAPIK3CDPIK3CBPIK3CG
SCHEMBL17678007 0.84 PIK3CA (0.46) PIK3CAPIK3CDPIK3CBPIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 — — US disclosed
US-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. 2019-05-23 — — US disclosed
EP-3204009-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BioMarin Pharmaceutical Inc. (US) 2017-08-16 — — EP disclosed
WO-2016057834-A9 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2017-04-13 — — WO disclosed
WO-2016057834-A9 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2017-04-13 — — WO disclosed
WO-2016057834-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-04-14 — — WO disclosed
WO-2016057834-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES BIOMARIN PHARMACEUTICAL INC. (US) 2016-04-14 — — WO 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-20190151312-A1 HEPARAN SULFATE BIOSYNTHESIS INHIBITORS FOR THE TREATMENT OF DISEASES HPSE, GAA, MAN2B1 PIK3CA 2468/4885PIK3CD 3238/4885PIK3CB 2252/4885

“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.

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