SCHEMBL1499149

SCHEMBL1499149

CCC(CN1CCN(S(=O)(=O)c2cccc(F)c2)CC1)n1cc(-c2ncnc3[nH]ccc23)cn1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYRO3 Q06418 2/20 0.49
JAK1 P23458 16/20 0.48
AXL P30530 1/20 0.48
MERTK Q12866 1/20 0.48
JAK2 O60674 17/20 0.46
JAK3 P52333 5/20 0.44
TYK2 P29597 2/20 0.44
CIT O14578 1/20 0.44
GAK O14976 1/20 0.44
ROCK2 O75116 1/20 0.44
ULK1 O75385 1/20 0.44
PRKCB P05771 1/20 0.44
RET P07949 1/20 0.44
PRKCA P17252 1/20 0.44
PRKACA P17612 1/20 0.44
MARK3 P27448 1/20 0.44
STAT3 P40763 1/20 0.44
CLK1 P49759 1/20 0.44
CSNK1G2 P78368 1/20 0.44
PRKCD Q05655 1/20 0.44

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
SCHEMBL2085637 0.93 TYRO3 (0.51) TYRO3JAK1AXLMERTKJAK2
SCHEMBL12780652 0.91 JAK1 (0.48) TYRO3JAK1AXLMERTKJAK2
SCHEMBL1499140 0.91 JAK2 (0.48) TYRO3JAK1AXLMERTKJAK2
SCHEMBL1499326 0.91 TYRO3 (0.50) TYRO3JAK1AXLMERTKJAK2
SCHEMBL1499134 0.91 JAK1 (0.49) TYRO3JAK1AXLMERTKJAK2
SCHEMBL1499192 0.89 JAK1 (0.61) TYRO3JAK1AXLMERTKJAK2
SCHEMBL2085803 0.88 TYRO3 (0.51) TYRO3JAK1AXLMERTKJAK2
SCHEMBL2086707 0.88 TYRO3 (0.51) TYRO3JAK1AXLMERTKJAK2
SCHEMBL1499226 0.87 TYRO3 (0.49) TYRO3JAK1AXLMERTKJAK2
Trifluoroacetic Acid SCHEMBL2086682 0.86 JAK2 (0.46) TYRO3JAK1AXLMERTKJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9249145-B2 Heterocyclic derivatives of pyrazol-4-yl-pyrrolo[2,3-d]pyrimidines as janus kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-02-02 US claimed
WO-2011028685-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-D]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2011-03-10 WO claimed
US-20110059951-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-d]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2011-03-10 US claimed
US-9249145-B2 Heterocyclic derivatives of pyrazol-4-yl-pyrrolo[2,3-d]pyrimidines as janus kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-02-02 US disclosed
US-9249145-B2 Heterocyclic derivatives of pyrazol-4-yl-pyrrolo[2,3-d]pyrimidines as janus kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-02-02 US disclosed
US-9249145-B2 Heterocyclic derivatives of pyrazol-4-yl-pyrrolo[2,3-d]pyrimidines as janus kinase inhibitors INCYTE HOLDINGS CORPORATION (US) 2016-02-02 US disclosed
WO-2011028685-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-D]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2011-03-10 WO disclosed
US-20110059951-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-d]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2011-03-10 US disclosed
US-20110059951-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-d]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2011-03-10 US disclosed
US-20110059951-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-d]PYRIMIDINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION 2011-03-10 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 (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-20110059951-A1 HETEROCYCLIC DERIVATIVES OF PYRAZOL-4-YL-PYRROLO[2,3-d]PYRIMIDINES AS JANUS KINASE INHIBITORS JAK3, JAK1, JAK2 TYRO3 107/4885JAK1 2/4885AXL 296/4885

“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.