SCHEMBL1607362

SCHEMBL1607362

C#CCNS(=O)(=O)c1cccc(Nc2nc(Nc3cc(C)c(OC)c(C)c3)ncc2F)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SYK P43405 10/20 0.51
AURKA O14965 3/20 0.48
EGFR P00533 2/20 0.48
ITK Q08881 1/20 0.48
CCNT1 O60563 2/20 0.47
CDK2 P24941 2/20 0.47
CDK9 P50750 2/20 0.47
CDK1 P06493 1/20 0.47
CCNB1 P14635 1/20 0.47
CCNA2 P20248 1/20 0.47
CDK7 P50613 1/20 0.47
CCNH P51946 1/20 0.47
GAK O14976 1/20 0.46
BTK Q06187 2/20 0.45
CCNE1 P24864 1/20 0.44
KDR P35968 1/20 0.44

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
SCHEMBL1606970 0.91 SYK (0.60) SYKAURKAEGFRITKCCNT1
SCHEMBL1606300 0.90 SYK (0.49) SYKAURKAEGFRITKCDK2
SCHEMBL1474139 0.86 JAK3 (0.57) SYKAURKAEGFRITKCCNT1
Ammonia Solution, Strong SCHEMBL1890400 0.85 CDK2 (0.46) SYKCCNT1CDK2CDK9CDK1
SCHEMBL1475250 0.84 JAK3 (0.56) SYKAURKAEGFRITKCCNT1
SCHEMBL1474887 0.83 SYK (0.56) SYKAURKAEGFRITKCDK2
SCHEMBL1474777 0.83 AURKA (0.56) SYKAURKAEGFRITKCCNT1
SCHEMBL1476189 0.81 JAK3 (0.57) SYKAURKAEGFRITKCCNT1
Ammonia Solution, Strong SCHEMBL1890157 0.81 CDK2 (0.42) CCNT1CDK2CDK9CDK1CCNB1
SCHEMBL1606723 0.78 SYK (0.52) SYKAURKAEGFRITKCCNT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8304422-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-11-06 US claimed
US-7947698-B2 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-05-24 US claimed
US-20110082146-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-04-07 US claimed
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-11-13 US claimed
US-8304422-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-11-06 US disclosed
US-7947698-B2 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. (US) 2011-05-24 US disclosed
US-20110082146-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2011-04-07 US disclosed
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-11-13 US disclosed
WO-2008118822-A1 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 (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-20110082146-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 SYK 62/4885AURKA 751/4885EGFR 529/4885
US-20080279867-A1 Prevent trabsplant rejection; autoimmune diseases JAK3, JAK1, JAK2 SYK 130/4885AURKA 3610/4885EGFR 1733/4885

“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.