SCHEMBL13878218

SCHEMBL13878218

c1nc(-c2cc[nH]c2)c2cc[nH]c2n1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 13/20 0.67
▸ IKBKB O14920 1/20 0.56
▸ CHUK O15111 1/20 0.56
▸ JAK3 P52333 8/20 0.54
▸ DAPK3 O43293 3/20 0.54
▸ PRKD3 O94806 3/20 0.54
▸ MAP4K4 O95819 3/20 0.54
▸ PAK4 O96013 3/20 0.54
▸ CSF1R P07333 3/20 0.54
▸ RET P07949 3/20 0.54
▸ MET P08581 3/20 0.54
▸ PIM1 P11309 3/20 0.54
▸ FGFR1 P11362 3/20 0.54
▸ PRKACA P17612 3/20 0.54
▸ FLT1 P17948 3/20 0.54
▸ LTK P29376 3/20 0.54
▸ GRK5 P34947 3/20 0.54
▸ KDR P35968 3/20 0.54
▸ CSNK1A1 P48729 3/20 0.54
▸ CLK2 P49760 3/20 0.54

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
SCHEMBL4006751 0.80 JAK2 (1.00) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL13765436 0.79 JAK2 (0.72) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL171455 0.78 JAK2 (0.61) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL27753707 0.77 JAK2 (0.70) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL15661177 0.77 JAK2 (0.70) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL4582353 0.77 JAK2 (0.70) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL4582349 0.77 JAK2 (0.70) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL31187292 0.76 JAK2 (0.63) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL22930855 0.76 JAK2 (0.58) JAK2IKBKBCHUKJAK3DAPK3
SCHEMBL13695624 0.75 JAK2 (0.61) JAK2IKBKBCHUKJAK3DAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3838903-B1 PYRROLO[2,3-D]PYRIMIDINE DERIVATIVE AS JANUS KINASE INHIBITOR INCYTE HOLDINGS CORP (US) 2023-11-22 — — EP disclosed
US-20140315931-A1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-10-23 — — US disclosed
US-20140315931-A1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-10-23 — — US disclosed
US-8741912-B2 Deazapurines useful as inhibitors of Janus kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-06-03 — — US disclosed
US-8741912-B2 Deazapurines useful as inhibitors of Janus kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2014-06-03 — — US disclosed
US-20120316186-A1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED 2012-12-13 — — US disclosed
US-20120316186-A1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES VERTEX PHARMACEUTICALS INCORPORATED 2012-12-13 — — US disclosed
US-20090088445-A1 Deazapurines useful as inhibitors of Janus kinases VERTEX PHARMACEUTICALS INCORPORATED 2009-04-02 — — US disclosed
US-20090088445-A1 Deazapurines useful as inhibitors of Janus kinases VERTEX PHARMACEUTICALS INCORPORATED 2009-04-02 — — 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 (3 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-20090088445-A1 Deazapurines useful as inhibitors of Janus kinases JAK1, JAK3, JAK2 JAK2 3/4885IKBKB 283/4885CHUK 62/4885
US-20140315931-A1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES JAK1, JAK3, JAK2 JAK2 3/4885IKBKB 283/4885CHUK 62/4885
US-20120316186-A1 DEAZAPURINES USEFUL AS INHIBITORS OF JANUS KINASES JAK1, JAK3, JAK2 JAK2 3/4885IKBKB 283/4885CHUK 62/4885

“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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