SCHEMBL15599378

SCHEMBL15599378

Cc1nn(Cc2cccc(C#N)c2)c(C)c1-c1c[nH]c2ncc(-c3ccc(N4CCN(Cl)CC4)cc3)cc12

nearest known ligand 0.56

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 4/20 0.56
TNIK Q9UKE5 5/20 0.52
KIT P10721 2/20 0.43
MAP4K1 Q92918 6/20 0.43
IL2 P60568 3/20 0.43
NTRK1 P04629 2/20 0.41
PIK3CA P42336 1/20 0.41
NEK1 Q96PY6 1/20 0.41

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
SCHEMBL17273427 0.93 ALK (0.57) ALKTNIKKITMAP4K1IL2
Hydrochloric Acid SCHEMBL17273277 0.92 ALK (0.56) ALKTNIKKITMAP4K1IL2
SCHEMBL15599391 0.90 ALK (0.59) ALKTNIKKITMAP4K1IL2
SCHEMBL15599468 0.89 ALK (0.58) ALKTNIKMAP4K1IL2
SCHEMBL15599469 0.89 ALK (0.69) ALKTNIKKITMAP4K1IL2
SCHEMBL15599359 0.87 ALK (0.56) ALKTNIKMAP4K1IL2
SCHEMBL15599271 0.87 ALK (0.56) ALKKITMAP4K1IL2NTRK1
SCHEMBL15558036 0.86 ALK (0.49) ALKTNIKKITMAP4K1IL2
SCHEMBL15599345 0.85 ALK (0.55) ALKTNIKMAP4K1IL2
SCHEMBL15599392 0.85 TNIK (0.54) ALKTNIKKITMAP4K1IL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9353107-B2 3-(pyrazolyl)-1H-pyrrolo[2,3-b]pyridine derivatives as kinase inhibitors AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2016-05-31 US disclosed
US-20150336949-A1 3-(Pyrazolyl)-1H-Pyrrolo[2,3-b]Pyridine Derivatives as Kinase Inhibitors Um Pharmauji Sdn. Bhd. (MY) 2015-11-26 US disclosed
WO-2014006554-A1 3-(PYRAZOLYL)-1H-PYRROLO[2,3-b]PYRIDINE DERIVATIVES AS KINASE INHIBITORS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2014-01-09 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 (1 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-20150336949-A1 3-(Pyrazolyl)-1H-Pyrrolo[2,3-b]Pyridine Derivatives as Kinase Inhibitors MAP3K3, MAP3K1, MAP3K6 ALK 408/4885TNIK 341/4885KIT 612/4885

“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.