SCHEMBL4410883

SCHEMBL4410883

N#CCC(C1CCCC1)n1cc(-c2ccnc(Nc3ccc(C(=O)N4CC[C@H](F)C4)cc3)n2)cn1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 3/20 0.51
▸ CCNE1 P24864 1/20 0.51
▸ JAK2 O60674 11/20 0.48
▸ JAK1 P23458 9/20 0.48
▸ JAK3 P52333 7/20 0.48
▸ TYK2 P29597 3/20 0.48
▸ ABL1 P00519 3/20 0.48
▸ GSK3B P49841 2/20 0.48
▸ AURKB Q96GD4 2/20 0.48
▸ KDR P35968 1/20 0.48
▸ STAT3 P40763 1/20 0.48
▸ CDK1 P06493 3/20 0.45
▸ CCNK O75909 3/20 0.45
▸ CDK12 Q9NYV4 3/20 0.45
▸ HDAC1 Q13547 1/20 0.41
▸ DAPK3 O43293 2/20 0.41
▸ PAK4 O96013 2/20 0.41
▸ RET P07949 2/20 0.41
▸ LTK P29376 2/20 0.41
▸ CSNK1A1 P48729 2/20 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
SCHEMBL2356068 1.00 CDK2 (0.51) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL4419912 0.98 CDK2 (0.47) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL2356144 0.98 CDK2 (0.47) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL3310409 0.93 CDK2 (0.51) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL4411765 0.93 CDK2 (0.51) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL2356179 0.93 CDK2 (0.51) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL2358030 0.92 CCNE1 (0.54) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL3307970 0.92 CCNE1 (0.54) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL2357124 0.91 CDK2 (0.52) CDK2CCNE1JAK2JAK1JAK3
SCHEMBL4408483 0.90 CDK2 (0.47) CDK2CCNE1JAK2JAK1JAK3

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
EP-2220068-B1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS INCYTE HOLDINGS CORP (US) 2016-01-27 — — EP disclosed
EP-2220068-B1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS INCYTE HOLDINGS CORP (US) 2016-01-27 — — EP disclosed
CN-101910152-B 4-pyrazolyl-N-arylpyrimidin-2-amines and 4-pyrazolyl-N-heteroarylpyrimidin-2-amines as janus kinase inhibitors INCYTE CORP 2014-08-06 — — CN disclosed
US-8309718-B2 4-pyrazolyl-N-arylpyrimidin-2-amines and 4-pyrazolyl-N-heteroarylpyrimidin-2-amines as janus kinase inhibitors INCYTE CORPORATION (US) 2012-11-13 — — US disclosed
US-8309718-B2 4-pyrazolyl-N-arylpyrimidin-2-amines and 4-pyrazolyl-N-heteroarylpyrimidin-2-amines as janus kinase inhibitors INCYTE CORPORATION (US) 2012-11-13 — — US disclosed
US-8309718-B2 4-pyrazolyl-N-arylpyrimidin-2-amines and 4-pyrazolyl-N-heteroarylpyrimidin-2-amines as janus kinase inhibitors INCYTE CORPORATION (US) 2012-11-13 — — US disclosed
CN-101910152-A 4-pyrazolyl-N-arylpyrimidin-2-amines and 4-pyrazolyl-N-heteroarylpyrimidin-2-amines as janus kinase inhibitors INCYTE CORP 2010-12-08 — — CN disclosed
US-20090318405-A1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-12-24 — — US disclosed
US-20090318405-A1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-12-24 — — US disclosed
US-20090318405-A1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-12-24 — — US disclosed
WO-2009064835-A1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2009-05-22 — — 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-20090318405-A1 4-PYRAZOLYL-N-ARYLPYRIMIDIN-2-AMINES AND 4-PYRAZOLYL-N-HETEROARYLPYRIMIDIN-2-AMINES AS JANUS KINASE INHIBITORS JAK1, JAK2, JAK3 CDK2 135/4885CCNE1 1514/4885JAK2 2/4885

“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.

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