SCHEMBL857007

SCHEMBL857007

c1cc2cc(-c3ccsc3)cnc2[nH]1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.64
▸ PIK3CA P42336 1/20 0.64
▸ PIK3CB P42338 1/20 0.64
▸ PIK3CG P48736 1/20 0.64
▸ CDK8 P49336 6/20 0.61
▸ AXL P30530 2/20 0.61
▸ RIPK1 Q13546 4/20 0.58
▸ BRD4 O60885 1/20 0.55
▸ PDGFRB P09619 5/20 0.54
▸ PDGFRA P16234 5/20 0.54
▸ PLK4 O00444 2/20 0.51
▸ ROCK2 O75116 2/20 0.51
▸ PRKD3 O94806 2/20 0.51
▸ MAP4K4 O95819 2/20 0.51
▸ INSR P06213 2/20 0.51
▸ CDK1 P06493 2/20 0.51
▸ ROS1 P08922 2/20 0.51
▸ FER P16591 2/20 0.51
▸ CDK2 P24941 2/20 0.51
▸ MARK3 P27448 2/20 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
SCHEMBL4831501 0.84 CDK8 (0.81) PIK3CDPIK3CAPIK3CBPIK3CGCDK8
SCHEMBL14365341 0.81 PIK3CD (0.47) PIK3CDPIK3CAPIK3CBPIK3CGCDK8
SCHEMBL29930506 0.79 PDGFRB (0.55) PIK3CACDK8AXLPDGFRBPDGFRA
SCHEMBL416750 0.78 PIK3CA (1.00) PIK3CDPIK3CAPIK3CBPIK3CGCDK8
SCHEMBL8501291 0.77 PDGFRB (0.51) PIK3CGCDK8AXLPDGFRBPDGFRA
SCHEMBL410704 0.76 CDK8 (1.00) PIK3CDPIK3CAPIK3CBPIK3CGCDK8
SCHEMBL3767742 0.76 MAP3K11 (0.78) CDK8ROCK2INSRCDK1CDK2
SCHEMBL415099 0.75 PIK3CA (0.70) PIK3CDPIK3CAPIK3CBPIK3CGCDK8
SCHEMBL22978455 0.73 RIPK1 (1.00) PIK3CDPIK3CAPIK3CBPIK3CGCDK8
SCHEMBL13854148 0.73 CDK8 (0.65) PIK3CDPIK3CAPIK3CBPIK3CGCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2018-04-26 — — US disclosed
US-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2018-04-26 — — US disclosed
US-20160176865-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2016-06-23 — — US disclosed
US-20160176865-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2016-06-23 — — US disclosed
US-20150290205-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2015-10-15 — — US disclosed
US-20150290205-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2015-10-15 — — US disclosed
US-20130261117-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2013-10-03 — — US disclosed
US-20130261117-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC. 2013-10-03 — — US disclosed
US-8470818-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2013-06-25 — — US disclosed
US-8470818-B2 Compounds and methods for kinase modulation, and indications therefor PLEXXIKON INC. (US) 2013-06-25 — — US disclosed
EP-1893612-A1 PYRROLO [2, 3-B]PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2008-03-05 — — EP disclosed
US-7291630-B2 Azaindoles as inhibitors of c-Jun N-terminal kinases EISAI CO., LTD. (JP) 2007-11-06 — — US disclosed
US-7291630-B2 Azaindoles as inhibitors of c-Jun N-terminal kinases EISAI CO., LTD. (JP) 2007-11-06 — — US disclosed
US-20070066641-A1 Compounds and methods for development of RET modulators PLEXXIKON, INC. 2007-03-22 — — US disclosed
CN-1925855-A Compounds and methods for development of Ret modulators PLEXXIKON INC (US) 2007-03-07 — — CN disclosed
US-20070049615-A1 Compounds and methods for development of Ret modulators PLEXXIKON, INC. 2007-03-01 — — US disclosed
WO-2007002433-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 — — WO disclosed
WO-2007002433-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 — — WO disclosed
EP-1696920-A2 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON, INC. (US) 2006-09-06 — — EP disclosed
WO-2005062795-A2 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON, INC. (US) 2005-07-14 — — 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 (6 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-20130261117-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PIK3CD 139/4885PIK3CA 79/4885PIK3CB 136/4885
US-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PIK3CD 139/4885PIK3CA 79/4885PIK3CB 136/4885
US-20150290205-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PIK3CD 139/4885PIK3CA 79/4885PIK3CB 136/4885
US-20070066641-A1 Compounds and methods for development of RET modulators RET, FGFR1, FGFR3 PIK3CD 2696/4885PIK3CA 2137/4885PIK3CB 2522/4885
US-20160176865-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 PIK3CD 139/4885PIK3CA 79/4885PIK3CB 136/4885
US-20070049615-A1 Compounds and methods for development of Ret modulators RET, GFRA1, GFRA3 PIK3CD 4141/4885PIK3CA 4402/4885PIK3CB 4063/4885

“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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