SCHEMBL410704

SCHEMBL410704

c1ccc(-c2cnc3[nH]ccc3c2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK8 P49336 11/20 1.00
▸ AXL P30530 2/20 1.00
▸ PIK3CA P42336 2/20 0.72
▸ PIK3CD O00329 1/20 0.72
▸ PIK3CB P42338 1/20 0.72
▸ PIK3CG P48736 1/20 0.72
▸ RIPK1 Q13546 4/20 0.70
▸ GLO1 Q04760 1/20 0.62
▸ CDK7 P50613 2/20 0.61
▸ MAP4K4 O95819 2/20 0.61
▸ CHEK2 O96017 2/20 0.61
▸ CDK1 P06493 2/20 0.61
▸ FES P07332 2/20 0.61
▸ ROS1 P08922 2/20 0.61
▸ FER P16591 2/20 0.61
▸ FLT4 P35916 2/20 0.61
▸ KDR P35968 2/20 0.61
▸ IRAK1 P51617 2/20 0.61
▸ ROCK1 Q13464 2/20 0.61
▸ PKN2 Q16513 2/20 0.61

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 0.90 CDK8 (0.81) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL13854142 0.86 CDK8 (0.74) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL4857195 0.84 CDK8 (0.73) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL29941056 0.84 CDK8 (0.73) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL416750 0.84 PIK3CA (1.00) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL3136284 0.83 CDK8 (0.71) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL411814 0.83 CDK8 (0.71) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL22978455 0.82 RIPK1 (1.00) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL410298 0.82 RIPK1 (0.71) CDK8AXLPIK3CAPIK3CDPIK3CB
SCHEMBL413503 0.82 RIPK1 (0.71) CDK8AXLPIK3CAPIK3CDPIK3CB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230002372-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS GLOBAL ALLIANCE FOR TB DRUG DEVELOPMENT INC (US) 2023-01-05 — — US disclosed
CN-109071536-A 5- phenyl 7-azaindole derivatives with AMPK activation 盐野义制药株式会社 2018-12-21 — — CN disclosed
CN-109071536-A 5- phenyl 7-azaindole derivatives with AMPK activation 盐野义制药株式会社 2018-12-21 — — CN disclosed
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-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR PLEXXIKON INC (US) 2018-04-26 — — US disclosed
EP-3096761-A1 SUBSTITUTED PYROOLOPYRIDINES AND PYRROLOPYRAZINES FOR TREATING CANCER OR INFLAMMATORY DISEASES Confluence Life Sciences, Inc. (US) 2016-11-30 — — EP disclosed
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
US-9499551-B2 Substituted pyrrolo[2,3-b]pyridines for treating cancer or inflammatory diseases CONFLUENCE LIFE SCIENCES, INC. (US) 2016-11-22 — — US disclosed
US-7291630-B2 Azaindoles as inhibitors of c-Jun N-terminal kinases EISAI CO., LTD. (JP) 2007-11-06 — — US disclosed
EP-1765819-A1 AZAINDOLES USEFUL AS INHIBITORS OF PROTEIN KINASES Vertex Pharmaceuticals Incorporated (US) 2007-03-28 — — EP disclosed
WO-2007002325-A1 PYRROLO[2,3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 — — WO disclosed
WO-2007002325-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
WO-2007002433-A1 PYRROLO [2, 3-B] PYRIDINE DERIVATIVES AS PROTEIN KINASE INHIBITORS PLEXXIKON, INC. (US) 2007-01-04 — — WO disclosed
WO-2006063167-A1 1H-PYRROLO[2,3-B]PYRIDINES SMITHKLINE BEECHAM CORPORATION (US) 2006-06-15 — — WO disclosed
US-20060122213-A1 Azaindoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED 2006-06-08 — — US disclosed
WO-2006004984-A1 AZAINDOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2006-01-12 — — WO disclosed
US-6369086-B1 Substituted oxidole derivatives as protein tyrosine and as protein serine/threonine kinase inhibitors SMITHKLINE BEECHAM CORPORATION 2002-04-09 — — 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 (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-20180111929-A1 COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR MAP3K20, MAP3K13, MAP3K8 CDK8 56/4885AXL 1354/4885PIK3CA 79/4885
US-20230002372-A1 AZAINDOLE CARBOXAMIDE COMPOUNDS FOR THE TREATMENT OF MYCOBACTERIAL INFECTIONS AZI2, AADAC, TPMT CDK8 564/4885AXL 2180/4885PIK3CA 2274/4885
US-20060122213-A1 Azaindoles useful as inhibitors of protein kinases PRKDC, ABL1, MAP3K20 CDK8 171/4885AXL 1288/4885PIK3CA 62/4885

“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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