SCHEMBL2697293

SCHEMBL2697293

CN(c1cncc(F)c1)c1cc(Nc2ccc(C#N)cc2)ncc1C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 1/20 0.39
▸ JAK2 O60674 12/20 0.39
▸ JAK3 P52333 7/20 0.39
▸ JAK1 P23458 8/20 0.39
▸ TYK2 P29597 3/20 0.39
▸ IRAK4 Q9NWZ3 4/20 0.39
▸ MAPK9 P45984 2/20 0.38
▸ MAPK10 P53779 2/20 0.38
▸ KCNH2 Q12809 2/20 0.37
▸ GRM5 P41594 1/20 0.36

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
SCHEMBL2696692 0.88 JAK2 (0.41) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2697897 0.87 SIRT2 (0.43) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2694914 0.86 MAPK9 (0.52) JAK2JAK3JAK1TYK2IRAK4
SCHEMBL2693081 0.85 CSF1R (0.40) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2697557 0.85 SYK (0.46) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2694449 0.85 CSF1R (0.45) CSF1RJAK2JAK1TYK2IRAK4
SCHEMBL2695812 0.84 SYK (0.47) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2695013 0.83 LMNA (0.47) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2693435 0.83 SYK (0.49) CSF1RJAK2JAK3JAK1TYK2
SCHEMBL2697541 0.83 IRAK4 (0.40) CSF1RJAK2JAK3JAK1TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-12-10 — — US claimed
EP-2635557-A2 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 — — EP claimed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — WO claimed
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 — — US claimed
EP-2975027-A1 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2016-01-20 — — EP disclosed
US-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS ALEXION PHARMACEUTICALS, INC. 2015-12-10 — — US disclosed
EP-2635557-A2 NICOTINAMIDES AS JAK KINASE MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 — — EP disclosed
WO-2012061428-A2 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 — — 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 (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-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK CSF1R 1106/4885JAK2 1/4885JAK3 4/4885
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK CSF1R 1106/4885JAK2 1/4885JAK3 4/4885

“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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