SCHEMBL10264983

SCHEMBL10264983

CC(C)(C)OC(=O)N1CCN(c2cccc(Nc3cc(NC4(c5ccccc5)CC4)c(C(N)=O)cn3)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 1/20 0.46
▸ JAK3 P52333 6/20 0.44
▸ JAK2 O60674 9/20 0.43
▸ JAK1 P23458 6/20 0.43
▸ PIK3CA P42336 1/20 0.42
▸ SYK P43405 2/20 0.41
▸ PTK2 Q05397 1/20 0.41
▸ TYK2 P29597 2/20 0.41
▸ IRAK4 Q9NWZ3 1/20 0.41
▸ GPR119 Q8TDV5 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ CCNK O75909 1/20 0.40
▸ CCNA2 P20248 1/20 0.40
▸ CDK2 P24941 1/20 0.40
▸ CCND3 P30281 1/20 0.40
▸ CDK9 P50750 1/20 0.40

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
SCHEMBL2694968 0.89 SYK (0.47) PTPN11JAK3JAK2JAK1SYK
SCHEMBL4403366 0.85 JAK3 (0.47) JAK3JAK2JAK1SYKTYK2
SCHEMBL2695976 0.84 MAPK10 (0.51) JAK3JAK2JAK1SYKTYK2
SCHEMBL2697251 0.84 JAK3 (0.46) JAK3JAK2JAK1SYKTYK2
SCHEMBL2695144 0.81 SYK (0.54) SYK
SCHEMBL2695387 0.79 SYK (0.52) JAK3JAK2JAK1SYKTYK2
SCHEMBL2693764 0.78 WNT3A (0.48) JAK3SYK
SCHEMBL4404194 0.77 STAT6 (0.50) JAK3JAK2JAK1SYKTYK2
SCHEMBL2695389 0.76 JAK3 (0.53) JAK3JAK2JAK1PIK3CATYK2
SCHEMBL2695768 0.76 MAPK10 (0.58) JAK3JAK2JAK1SYKTYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 PTPN11 159/4885JAK3 4/4885JAK2 1/4885
US-20120108566-A1 NICOTINAMIDES AS JAK KINASE MODULATORS JAK2, JAK1, NADK PTPN11 159/4885JAK3 4/4885JAK2 1/4885

“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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