SCHEMBL1638468

SCHEMBL1638468

C[C@@H](c1cc(C(=O)N(C)C)cc2c(=O)cc(N3CCOCC3)oc12)N(C)c1cc(F)cc(F)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PIK3CB P42338 20/20 1.00
▸ PIK3CD O00329 6/20 1.00
▸ PIK3CA P42336 6/20 1.00
▸ PIK3CG P48736 6/20 1.00
▸ KCNH2 Q12809 1/20 1.00
▸ PIK3R1 P27986 1/20 0.75
▸ TOP2B Q02880 1/20 0.75
▸ ERN2 Q76MJ5 1/20 0.75

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
SCHEMBL1636910 1.00 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1639356 1.00 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1639409 0.94 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1639138 0.93 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1636999 0.93 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1639423 0.93 PIK3CB (0.86) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1637570 0.92 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL17552956 0.92 PIK3CB (0.84) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1638625 0.91 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2
SCHEMBL1638295 0.91 PIK3CB (1.00) PIK3CBPIK3CDPIK3CAPIK3CGKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9718800-B2 Chromenone derivatives ASTRAZENECA AB (SE) 2017-08-01 — — US disclosed
US-20160272607-A1 CHROMENONE DERIVATIVES ASTRAZENECA AB (SE) 2016-09-22 — — US disclosed
US-20160060240-A1 CHROMENONE DERIVATIVES ASTRAZENECA AB (SE) 2016-03-03 — — US disclosed
US-9029374-B2 Chromenone derivatives ASTRAZENECA AB (SE) 2015-05-12 — — US disclosed
US-20140194419-A1 CHROMENONE DERIVATIVES ASTRAZENECA AB (SE) 2014-07-10 — — US disclosed
US-8673906-B2 Chromenone derivatives ASTRAZENECA AB (SE) 2014-03-18 — — US disclosed
US-20130158026-A1 CHROMENONE DERIVATIVES ASTRAZENECA INTELLECTUAL PROPERTY (GB) 2013-06-20 — — US disclosed
US-8399460-B2 Chromenone derivatives ASTRAZENECA AB (GB) 2013-03-19 — — US disclosed
US-20110098271-A1 CHROMENONE DERIVATIVES ASTRAZENECA AB (SE) 2011-04-28 — — 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 (5 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-20110098271-A1 CHROMENONE DERIVATIVES RB1, CYP11B1, CCND3 PIK3CB 3920/4885PIK3CD 3037/4885PIK3CA 2099/4885
US-20160272607-A1 CHROMENONE DERIVATIVES RB1, CYP11B1, CCND3 PIK3CB 3920/4885PIK3CD 3037/4885PIK3CA 2099/4885
US-20140194419-A1 CHROMENONE DERIVATIVES RB1, CYP11B1, CCND3 PIK3CB 3920/4885PIK3CD 3037/4885PIK3CA 2099/4885
US-20130158026-A1 CHROMENONE DERIVATIVES RB1, CYP11B1, CCND3 PIK3CB 3920/4885PIK3CD 3037/4885PIK3CA 2099/4885
US-20160060240-A1 CHROMENONE DERIVATIVES RB1, CYP11B1, CCND3 PIK3CB 3920/4885PIK3CD 3037/4885PIK3CA 2099/4885

“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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