SCHEMBL2473777

SCHEMBL2473777

CCNS(=O)(=O)NCc1ccc(Nc2nc(Nc3cccc(S(N)(=O)=O)c3)ncc2Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 5/20 0.61
JAK3 P52333 8/20 0.51
CDK1 P06493 6/20 0.51
CDK2 P24941 6/20 0.51
CDK5 Q00535 5/20 0.51
SYK P43405 4/20 0.51
PTK2 Q05397 3/20 0.51
FLT3 P36888 3/20 0.51
AURKA O14965 3/20 0.51
DCLK1 O15075 3/20 0.51
PDPK1 O15530 3/20 0.51
JAK2 O60674 3/20 0.51
ROCK2 O75116 3/20 0.51
MAP4K4 O95819 3/20 0.51
PRKCG P05129 3/20 0.51
LCK P06239 3/20 0.51
FYN P06241 3/20 0.51
LYN P07948 3/20 0.51
RET P07949 3/20 0.51
IGF1R P08069 3/20 0.51

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
SCHEMBL2472009 0.94 NTRK1 (0.67) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL2471442 0.91 NTRK1 (0.64) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL2470368 0.91 NTRK1 (0.57) NTRK1CDK1CDK2CDK5PTK2
SCHEMBL2473715 0.90 JAK3 (0.64) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL17685310 0.89 JAK3 (0.57) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL2470400 0.89 NTRK1 (0.59) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL2475718 0.88 NTRK1 (0.60) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL2474747 0.87 BRD4 (0.58) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL4975164 0.86 NTRK1 (0.59) NTRK1JAK3CDK1CDK2CDK5
SCHEMBL2475802 0.83 JAK3 (0.60) NTRK1JAK3CDK1CDK2CDK5

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 4361/4885JAK3 1/4885CDK1 155/4885
US-20120301486-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 NTRK1 4361/4885JAK3 1/4885CDK1 155/4885

“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.