SCHEMBL1197940

SCHEMBL1197940

NC(=O)COc1ccc(Nc2nc(Nc3cccc(C(N)=O)c3)ncc2F)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 16/20 0.80
AURKA O14965 4/20 0.64
JAK2 O60674 4/20 0.64
AURKB Q96GD4 3/20 0.64
CDK2 P24941 3/20 0.59
EGFR P00533 3/20 0.59
LYN P07948 3/20 0.59
JAK3 P52333 3/20 0.59
ITK Q08881 3/20 0.59
PLK4 O00444 2/20 0.59
PDPK1 O15530 2/20 0.59
DAPK3 O43293 2/20 0.59
MAP4K4 O95819 2/20 0.59
PAK4 O96013 2/20 0.59
CHEK2 O96017 2/20 0.59
ERBB2 P04626 2/20 0.59
NTRK1 P04629 2/20 0.59
PRKCG P05129 2/20 0.59
INSR P06213 2/20 0.59
LCK P06239 2/20 0.59

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
SCHEMBL1196774 0.93 SYK (0.69) SYKAURKAJAK2AURKBEGFR
SCHEMBL1196984 0.90 SYK (0.74) SYKAURKAJAK2AURKB
SCHEMBL1198129 0.90 SYK (0.78) SYKAURKAJAK2AURKBCDK2
SCHEMBL28753633 0.89 SYK (1.00) SYKAURKAJAK2AURKBCDK2
SCHEMBL27631623 0.89 SYK (1.00) SYKAURKAJAK2AURKBCDK2
SCHEMBL1197542 0.88 EGFR (0.67) SYKAURKAJAK2AURKBCDK2
SCHEMBL1197903 0.88 SYK (0.75) SYKAURKAJAK2AURKBCDK2
SCHEMBL1197936 0.87 SYK (0.78) SYKAURKAJAK2AURKBCDK2
SCHEMBL4253356 0.86 SYK (0.80) SYKAURKAJAK2AURKBCDK2
SCHEMBL1196706 0.85 CDK2 (0.77) SYKAURKAJAK2AURKBCDK2

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-7834024-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2010-11-16 US claimed
US-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2008-10-23 US claimed
WO-2008118823-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 WO claimed
US-8299087-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-10-30 US disclosed
US-20110027856-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-02-03 US disclosed
US-7834024-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2010-11-16 US disclosed
US-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2008-10-23 US disclosed
WO-2008118823-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2008-10-02 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 (1 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-20080260754-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 SYK 62/4885AURKA 751/4885JAK2 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.