SCHEMBL2472019

SCHEMBL2472019

CCNS(=O)(=O)NCc1ccc(Nc2nc(Nc3cc(C)c(S(N)(=O)=O)c(C)c3)ncc2Cl)c(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 3/20 0.43
CCNA2 P20248 5/20 0.41
CDK2 P24941 5/20 0.41
CDK9 P50750 4/20 0.41
CCNK O75909 3/20 0.41
CCND3 P30281 2/20 0.41
CDK6 Q00534 2/20 0.41
PTK2 Q05397 4/20 0.41
ALK Q9UM73 3/20 0.40
AXL P30530 3/20 0.39
STK17A Q9UEE5 3/20 0.39
STK17B O94768 2/20 0.39
MET P08581 2/20 0.38
BTK Q06187 2/20 0.38
MAPK3 P27361 1/20 0.38
CDC7 O00311 1/20 0.38
PLK4 O00444 1/20 0.38
CHEK1 O14757 1/20 0.38
AURKA O14965 1/20 0.38
DCLK1 O15075 1/20 0.38

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
SCHEMBL2468711 0.90 NTRK1 (0.55) NTRK1CCNA2CDK2CDK9CCNK
SCHEMBL2473723 0.89 NTRK1 (0.41) NTRK1CCNA2CDK2CDK9CCNK
SCHEMBL1606776 0.88 PTK2 (0.42) NTRK1CCNA2CDK2CDK9CCNK
SCHEMBL1607130 0.88 ALK (0.47) NTRK1CCNA2CDK2CDK9CCNK
SCHEMBL2470400 0.87 NTRK1 (0.59) NTRK1CCNA2CDK2CDK9CCND3
SCHEMBL1606740 0.81 CCNK (0.63) NTRK1CCNA2CDK2CDK9CCNK
SCHEMBL1606946 0.81 BRD4 (0.54) CCNA2CDK2CDK9CCNKCCND3
SCHEMBL2475717 0.80 BRD4 (0.46) NTRK1CCNA2CDK2PTK2ALK
SCHEMBL2474071 0.79 NTRK1 (0.53) NTRK1CCNA2CDK2CDK9PTK2
SCHEMBL1607687 0.78 PTK2 (0.41) NTRK1CCNA2CDK2CDK9CCNK

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
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-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 (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-20100158921-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 NTRK1 4361/4885CCNA2 1836/4885CDK2 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.