SCHEMBL3765160

SCHEMBL3765160

c1ccc(-c2cnc3[nH]cc(-c4ccncc4)c3c2)cc1

nearest known ligand 0.85

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CDK8 P49336 4/20 0.85
AXL P30530 3/20 0.85
TNIK Q9UKE5 1/20 0.85
NTRK1 P04629 7/20 0.75
PIK3CA P42336 1/20 0.74
SGK1 O00141 3/20 0.67
CAMKK2 Q96RR4 1/20 0.67
NEK1 Q96PY6 1/20 0.65

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
SCHEMBL8941685 0.92 AXL (1.00) CDK8AXLTNIKNTRK1SGK1
SCHEMBL4171362 0.89 NTRK1 (0.70) CDK8AXLTNIKNTRK1PIK3CA
SCHEMBL18576768 0.86 NTRK1 (1.00) CDK8AXLTNIKNTRK1PIK3CA
SCHEMBL12763245 0.85 NTRK1 (0.73) CDK8AXLTNIKNTRK1PIK3CA
SCHEMBL18576899 0.85 NTRK1 (1.00) NTRK1PIK3CANEK1
SCHEMBL8322551 0.85 AXL (0.85) CDK8AXLTNIKNTRK1SGK1
SCHEMBL15833892 0.84 DYRK1A (0.89) CDK8AXLTNIKSGK1CAMKK2
SCHEMBL8320989 0.84 AXL (0.83) CDK8AXLTNIKNTRK1SGK1
SCHEMBL3764839 0.84 AXL (0.83) CDK8AXLTNIKNTRK1PIK3CA
SCHEMBL3771174 0.84 DYRK1A (0.89) CDK8AXLTNIKSGK1CAMKK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120238588-A1 1H-Pyrrolo[2,3-B]Pyridines GlaxoSmithKline, LLC 2012-09-20 US claimed
WO-2010049173-A1 USE OF INHIBITORS OF HOST KINASES FOR THE TREATMENT OF INFECTIOUS DISEASES CENIX BIOSCIENCE GMBH (DE) 2010-05-06 WO claimed
US-20090233955-A1 1H-Pyrrolo[2,3-B]Pyridnes GLAXOSMITHKLINE LLC 2009-09-17 US claimed
EP-1828180-A1 1H-PYRROLO[2,3-BETA]PYRIDINES SMITHKLINE BEECHAM CORPORATION (US) 2007-09-05 EP claimed
WO-2006063167-A1 1H-PYRROLO[2,3-B]PYRIDINES SMITHKLINE BEECHAM CORPORATION (US) 2006-06-15 WO claimed
WO-2021006707-A1 USE OF SGK1 INHIBITOR AS THERAPEUTIC AGENT FOR INFLAMMATORY NEUROLOGICAL DISEASES 한양대학교 산학협력단 2021-01-14 WO disclosed
US-20120238588-A1 1H-Pyrrolo[2,3-B]Pyridines GlaxoSmithKline, LLC 2012-09-20 US disclosed
WO-2010049173-A1 USE OF INHIBITORS OF HOST KINASES FOR THE TREATMENT OF INFECTIOUS DISEASES CENIX BIOSCIENCE GMBH (DE) 2010-05-06 WO disclosed
US-20090233955-A1 1H-Pyrrolo[2,3-B]Pyridnes GLAXOSMITHKLINE LLC 2009-09-17 US disclosed
EP-1828180-A1 1H-PYRROLO[2,3-BETA]PYRIDINES SMITHKLINE BEECHAM CORPORATION (US) 2007-09-05 EP disclosed
WO-2006063167-A1 1H-PYRROLO[2,3-B]PYRIDINES SMITHKLINE BEECHAM CORPORATION (US) 2006-06-15 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 (2 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-20090233955-A1 1H-Pyrrolo[2,3-B]Pyridnes SGK1, SGK2, SGK3 CDK8 525/4885AXL 1542/4885TNIK 212/4885
US-20120238588-A1 1H-Pyrrolo[2,3-B]Pyridines SGK1, SGK2, SGK3 CDK8 639/4885AXL 1432/4885TNIK 213/4885

“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.