SCHEMBL391747

SCHEMBL391747

CS(=O)(=O)N1CCN(Cc2cc3nc(-c4cccc5[nH]ccc45)nc(N4CCOCC4)c3s2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 18/20 1.00
PIK3CA P42336 16/20 0.80
PIK3CB P42338 15/20 0.80
PIK3CG P48736 15/20 0.80
PIK3C2A O00443 1/20 0.80
PLK4 O00444 1/20 0.80
PIK3R2 O00459 1/20 0.80
PIK3C2B O00750 1/20 0.80
GAK O14976 1/20 0.80
EPHB6 O15197 1/20 0.80
DAPK3 O43293 1/20 0.80
STK16 O75716 1/20 0.80
PIK3C2G O75747 1/20 0.80
NTRK1 P04629 1/20 0.80
NQO2 P16083 1/20 0.80
CSNK2A2 P19784 1/20 0.80
JAK1 P23458 1/20 0.80
PIK3R1 P27986 1/20 0.80
TYK2 P29597 1/20 0.80
AKT1 P31749 1/20 0.80

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
SCHEMBL29482127 1.00 PIK3CD (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2A
SCHEMBL393696 0.90 PIK3CD (0.81) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2469939 0.90 PIK3CD (0.81) PIK3CDPIK3CAPIK3CBPIK3CG
Pictilisib SCHEMBL190812 0.89 PIK3CA (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2A
Pictilisib SCHEMBL29387739 0.89 PIK3CA (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2A
Pictilisib SCHEMBL14859338 0.89 PIK3CA (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2A
Pictilisib SCHEMBL29375636 0.89 PIK3CA (1.00) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2A
SCHEMBL2465953 0.89 PIK3CD (0.79) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2466623 0.89 PIK3CD (0.79) PIK3CDPIK3CAPIK3CBPIK3CG
SCHEMBL2436174 0.88 PIK3CA (0.80) PIK3CDPIK3CAPIK3CBPIK3CGPIK3C2A

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1812444-B1 PHARMACEUTICAL COMPOUNDS PIRAMED LTD (GB) 2015-08-26 EP claimed
US-8101607-B2 Pharmaceutical compounds F. HOFFMAN-LA ROCHE AG (CH) 2012-01-24 US claimed
US-20100280027-A1 PHARMACEUTICAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2010-11-04 US claimed
US-7776856-B2 Pharmaceutical compounds F. HOFFMAN-LA ROCHE AG (CH) 2010-08-17 US claimed
US-20090131429-A1 Pharmaceutical compounds F. HOFFMANN-LA ROCHE AG (CH) 2009-05-21 US claimed
EP-1812444-A1 PHARMACEUTICAL COMPOUNDS Piramed Limited (GB) 2007-08-01 EP claimed
WO-2006046035-A1 PHARMACEUTICAL COMPOUNDS PIRAMED LIMITED (GB) 2006-05-04 WO claimed
CN-110248963-B anti-CCR 7 antibody drug conjugates 诺华股份有限公司 2023-12-26 CN disclosed
CN-116096426-A CCR7 antibody drug conjugates for the treatment of cancer 诺华股份有限公司 2023-05-09 CN disclosed
US-20220402934-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY CURIS INC (US) 2022-12-22 US disclosed
CN-108341873-B Antibodies to epidermal growth factor receptor 3(HER3) 诺华股份有限公司 2022-03-25 CN disclosed
CN-108367003-B Treatment of breast cancer brain metastasis 麻省总医院 2022-01-21 CN disclosed
CN-113195541-A Antibodies against PMEL17 and conjugates thereof 诺华股份有限公司 2021-07-30 CN disclosed
CN-103080134-A Antibodies to epidermal growth factor receptor 3(HER3) NOVARTIS AG 2013-05-01 CN disclosed
US-8101607-B2 Pharmaceutical compounds F. HOFFMAN-LA ROCHE AG (CH) 2012-01-24 US disclosed
US-20100280027-A1 PHARMACEUTICAL COMPOUNDS F. HOFFMANN-LA ROCHE AG (CH) 2010-11-04 US disclosed
US-7776856-B2 Pharmaceutical compounds F. HOFFMAN-LA ROCHE AG (CH) 2010-08-17 US disclosed
US-20090131429-A1 Pharmaceutical compounds F. HOFFMANN-LA ROCHE AG (CH) 2009-05-21 US disclosed
EP-1812444-A1 PHARMACEUTICAL COMPOUNDS Piramed Limited (GB) 2007-08-01 EP disclosed
WO-2006046035-A1 PHARMACEUTICAL COMPOUNDS PIRAMED LIMITED (GB) 2006-05-04 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 (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-20100280027-A1 PHARMACEUTICAL COMPOUNDS PIK3CA, PIK3C2B, PIK3C2A PIK3CD 4/4885PIK3CA 1/4885PIK3CB 5/4885
US-20090131429-A1 Pharmaceutical compounds PIK3CA, PIK3C2B, PIK3CD PIK3CD 3/4885PIK3CA 1/4885PIK3CB 12/4885
US-20220402934-A1 PHOSPHOINOSITIDE 3-KINASE INHIBITORS WITH A ZINC BINDING MOIETY BAZ2A, BAZ2B, PI4KB PIK3CD 37/4885PIK3CA 57/4885PIK3CB 23/4885

“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.