SCHEMBL1762783

SCHEMBL1762783

CCc1cnc(-n2ccc3cc(-c4c(CC)cccc4CC)ncc32)nc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 1/20 0.35
GPR119 Q8TDV5 5/20 0.35
MAPT P10636 9/20 0.32
DHODH Q02127 1/20 0.32
PLK2 Q9NYY3 1/20 0.32
PARP1 P09874 1/20 0.32

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
SCHEMBL1762624 0.85 PTK2 (0.35) PTK2MAPTPLK2
SCHEMBL1762768 0.85 PTK2 (0.35) PTK2MAPTPLK2
SCHEMBL1762713 0.84 DGAT1 (0.42) PTK2MAPT
SCHEMBL1762893 0.82 PTK2 (0.39) PTK2MAPTDHODH
SCHEMBL1763310 0.82 MAPT (0.38) PTK2MAPT
SCHEMBL1762789 0.82 PTK2 (0.34) PTK2MAPTPLK2
SCHEMBL1762852 0.81 MAPT (0.37) PTK2MAPT
SCHEMBL1762891 0.81 MAPT (0.37) PTK2MAPT
SCHEMBL1762583 0.81 PTK2 (0.53) PTK2MAPT
SCHEMBL1762865 0.80 PTK2 (0.35) PTK2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8633193-B2 Pyrrolo-pyridine, pyrrolo-pyrimidine and related heterocyclic compounds NOVARTIS AG (CH) 2014-01-21 US disclosed
US-20110118273-A1 PYRROLO-PYRIDINE, PYRROLO-PYRIMIDINE AND RELATED HETEROCYCLIC COMPOUNDS NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-05-19 US disclosed
US-7906528-B2 Such as 5-(2,6-diethyl-phenyl)-1H-pyrrolo[2,3-C]pyridine, which binds C5a receptors with high affinity; for treatment of inflammatory, cardiovascular, and immune system disorders; kits NOVARTIS INTERNATIONAL PHARMACEUTICAL LTD. (BM) 2011-03-15 US disclosed
US-20080267887-A1 Pyrrolo-Pyridine, Pyrrolo-Pyrimidine and Related Heterocyclic Compounds NEUROGEN CORPORATION (US) 2008-10-30 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 (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-20110118273-A1 PYRROLO-PYRIDINE, PYRROLO-PYRIMIDINE AND RELATED HETEROCYCLIC COMPOUNDS C5AR1, C5AR2, C3AR1 PTK2 1795/4885GPR119 409/4885MAPT 4578/4885
US-20080267887-A1 Pyrrolo-Pyridine, Pyrrolo-Pyrimidine and Related Heterocyclic Compounds C5AR1, C5AR2, C3AR1 PTK2 1795/4885GPR119 409/4885MAPT 4578/4885

“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.