SCHEMBL1196773

SCHEMBL1196773

N#CCc1ccc(Nc2nc(Nc3cccc(C#N)c3)ncc2F)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.79
BTK Q06187 2/20 0.57
EGFR P00533 1/20 0.57
CDC7 O00311 1/20 0.56
AURKA O14965 4/20 0.53
KDR P35968 2/20 0.53
PLK4 O00444 1/20 0.53
PDPK1 O15530 1/20 0.53
JAK2 O60674 1/20 0.53
PRKD3 O94806 1/20 0.53
MAP4K4 O95819 1/20 0.53
NTRK1 P04629 1/20 0.53
INSR P06213 1/20 0.53
LCK P06239 1/20 0.53
FYN P06241 1/20 0.53
CDK1 P06493 1/20 0.53
FES P07332 1/20 0.53
CSF1R P07333 1/20 0.53
LYN P07948 1/20 0.53
IGF1R P08069 1/20 0.53

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
SCHEMBL1198296 0.89 SYK (0.81) SYKBTKEGFRAURKAKDR
SCHEMBL655532 0.89 SYK (1.00) SYKBTKEGFRCDC7AURKA
SCHEMBL1198512 0.88 SYK (0.68) SYKBTKEGFRAURKAKDR
SCHEMBL1197543 0.86 SYK (0.80) SYKBTKEGFRCDC7AURKA
SCHEMBL1198249 0.85 SYK (0.59) SYKBTKAURKAKDRPLK4
SCHEMBL1196957 0.85 SYK (0.71) SYKBTKEGFRCDC7AURKA
SCHEMBL4001352 0.83 SYK (0.61) SYKBTKEGFRCDC7AURKA
SCHEMBL1197653 0.83 AURKA (0.62) SYKEGFRAURKAJAK2CDK2
SCHEMBL1198381 0.83 SYK (0.57) SYKBTKAURKAKDRPLK4
SCHEMBL656319 0.82 SYK (0.86) SYKBTKEGFRAURKAMAPK8

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 62/4885BTK 10/4885EGFR 529/4885

“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.