SCHEMBL914805

SCHEMBL914805

Cn1cc(CNc2nc(Nc3ccc4c(c3)NC(=O)C(C)(C)O4)ncc2C(N)=O)cn1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 12/20 0.57
▸ SYK P43405 4/20 0.52
▸ JAK1 P23458 5/20 0.50
▸ JAK2 O60674 5/20 0.50
▸ STAT6 P42226 4/20 0.48

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
SCHEMBL14974313 0.88 STAT6 (0.57) JAK3SYKJAK1JAK2STAT6
SCHEMBL914264 0.83 JAK3 (0.56) JAK3SYKJAK1STAT6
SCHEMBL914801 0.81 SYK (0.49) JAK3SYKJAK1JAK2
SCHEMBL913159 0.79 JAK3 (0.59) JAK3JAK1JAK2STAT6
SCHEMBL22261209 0.79 JAK3 (0.79) JAK3JAK1JAK2
SCHEMBL913836 0.77 JAK1 (0.52) JAK3SYKJAK1JAK2
SCHEMBL912912 0.76 JAK3 (0.67) JAK3JAK1JAK2STAT6
SCHEMBL3790334 0.74 JAK3 (0.60) JAK3SYKJAK1JAK2STAT6
SCHEMBL20844385 0.73 JAK3 (0.78) JAK3JAK1JAK2STAT6
SCHEMBL22261282 0.72 JAK3 (0.79) JAK3JAK1JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — US claimed
US-20110005947-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2011-01-13 — — US claimed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 — — US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 — — US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 — — US disclosed
US-20110005947-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2011-01-13 — — 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-20130137673-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 JAK3 3/4885SYK 72/4885JAK1 1/4885
US-20110005947-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 JAK3 3/4885SYK 72/4885JAK1 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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