SCHEMBL2693091

SCHEMBL2693091

COCC(=O)N1CC(c2ccc(Nc3cc(N(C)c4cccc(F)n4)c(C(N)=O)cn3)cc2)C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 9/20 0.41
▸ JAK2 O60674 4/20 0.40
▸ JAK1 P23458 4/20 0.40
▸ SYK P43405 4/20 0.40
▸ STAT6 P42226 3/20 0.37
▸ IRAK4 Q9NWZ3 2/20 0.35
▸ TYK2 P29597 1/20 0.35
▸ LCK P06239 2/20 0.33
▸ BTK Q06187 2/20 0.33
▸ EGFR P00533 1/20 0.33
▸ P2RX3 P56373 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33

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
SCHEMBL2694937 0.92 JAK3 (0.47) JAK3JAK2JAK1SYKSTAT6
SCHEMBL2693089 0.83 JAK3 (0.51) JAK3JAK2JAK1SYKSTAT6
SCHEMBL2695356 0.81 JAK3 (0.40) JAK3JAK2JAK1SYKSTAT6
SCHEMBL2692782 0.80 CSF1R (0.44) JAK3JAK2JAK1SYKIRAK4
SCHEMBL2696685 0.78 SYK (0.48) JAK3JAK2JAK1SYKIRAK4
SCHEMBL2695760 0.78 SYK (0.52) JAK3JAK2JAK1SYKTYK2
SCHEMBL2694009 0.78 SIRT2 (0.44) JAK3JAK2JAK1SYKIRAK4
SCHEMBL2695112 0.77 JAK3 (0.63) JAK3JAK2JAK1SYKSTAT6
SCHEMBL2695292 0.77 MAPK9 (0.53) JAK3JAK2JAK1SYKIRAK4
SCHEMBL2696558 0.76 SYK (0.46) JAK3JAK2JAK1SYKIRAK4

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-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
US-9102625-B2 Nicotinamides as JAK kinase modulators PORTOLA PHARMACEUTICALS, INC. (US) 2015-08-11 — — 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
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-03 — — 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-20150353495-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK JAK3 4/4885JAK2 1/4885JAK1 2/4885
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK JAK3 4/4885JAK2 1/4885JAK1 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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