SCHEMBL2472009

SCHEMBL2472009

CCNS(=O)(=O)NCc1cccc(Nc2nc(Nc3cccc(S(N)(=O)=O)c3)ncc2Cl)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.67
CDK1 P06493 7/20 0.52
CDK2 P24941 7/20 0.52
CDK5 Q00535 5/20 0.52
CCNT1 O60563 4/20 0.52
CCNB1 P14635 4/20 0.52
CDK9 P50750 4/20 0.52
CCNE1 P24864 2/20 0.52
CDK5R1 Q15078 2/20 0.52
CCNB2 O95067 1/20 0.52
CCNE2 O96020 1/20 0.52
CCNB3 Q8WWL7 1/20 0.52
JAK3 P52333 7/20 0.49
JAK2 O60674 4/20 0.49
AURKA O14965 3/20 0.49
DCLK1 O15075 3/20 0.49
PDPK1 O15530 3/20 0.49
ROCK2 O75116 3/20 0.49
MAP4K4 O95819 3/20 0.49
EGFR P00533 3/20 0.49

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
SCHEMBL2473777 0.94 NTRK1 (0.61) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL2471442 0.94 NTRK1 (0.64) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL2475802 0.90 JAK3 (0.60) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL2470400 0.90 NTRK1 (0.59) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL2474363 0.89 NTRK1 (0.59) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL2470368 0.84 NTRK1 (0.57) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL2474786 0.83 JAK3 (0.56) NTRK1CDK1CDK2CDK5JAK3
SCHEMBL2473715 0.83 JAK3 (0.64) NTRK1CDK1CDK2CDK5CCNT1
SCHEMBL1607532 0.83 NTRK1 (0.46) NTRK1JAK3JAK2EGFRSYK
SCHEMBL1607607 0.83 NTRK1 (0.46) NTRK1CDK2CDK9JAK3JAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2370415-B1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS INC (US) 2016-04-20 EP claimed
US-8268851-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-09-18 US claimed
EP-2370415-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY Rigel Pharmaceuticals, Inc. (US) 2011-10-05 EP claimed
WO-2010075558-A2 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-07-01 WO claimed
US-20100158921-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-06-24 US claimed
EP-2370415-B1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS INC (US) 2016-04-20 EP disclosed
US-8420659-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2013-04-16 US disclosed
US-20120301486-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY Riger Pharmaceuticals, Inc. 2012-11-29 US disclosed
US-8268851-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2012-09-18 US disclosed
US-20100158921-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-06-24 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-20100158921-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 NTRK1 4361/4885CDK1 155/4885CDK2 236/4885
US-20120301486-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 NTRK1 4361/4885CDK1 155/4885CDK2 236/4885

“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.