SCHEMBL4097308

SCHEMBL4097308

C=C(c1ccccc1)c1cnn(-c2ccnc3c2ccn3OC(=O)C(F)(F)F)c1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ ALKBH2 Q6NS38 2/20 0.34
▸ EGLN1 Q9GZT9 1/20 0.34
▸ ALKBH1 Q13686 6/20 0.32
▸ HPGDS O60760 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
SCHEMBL4082073 0.84 GRM4 (0.34) —
SCHEMBL4095838 0.78 ABL1 (0.42) —
SCHEMBL18599175 0.77 ALKBH2 (0.34) ALKBH2EGLN1ALKBH1HPGDS
SCHEMBL4099618 0.77 MAPKAPK2 (0.43) EGLN1
SCHEMBL4087925 0.76 PDE3B (0.33) —
SCHEMBL4092534 0.75 PDE10A (0.33) —
Trifluoroacetic Acid SCHEMBL4097306 0.74 PRKCI (0.50) ALKBH2EGLN1
SCHEMBL4092722 0.73 GRM4 (0.51) —
SCHEMBL4096044 0.73 KIT (0.32) —
SCHEMBL4082704 0.72 GRM4 (0.42) —

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-20130137681-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2013-05-30 — — US disclosed
US-8415362-B2 Pyrazolyl substituted pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE CORPORATION (US) 2013-04-09 — — US disclosed
US-20090181959-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-07-16 — — 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-20130137681-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 ALKBH2 1978/4885EGLN1 2363/4885ALKBH1 2523/4885
US-20090181959-A1 HETEROARYL SUBSTITUTED PYRROLO[2,3-b]PYRIDINES AND PYRROLO[2,3-b]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 ALKBH2 1978/4885EGLN1 2363/4885ALKBH1 2523/4885

“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.

Send feedback