SCHEMBL2474071

SCHEMBL2474071

Cc1cc(CNS(=O)(=O)NC2CC2)ccc1Nc1nc(Nc2ccc(S(N)(=O)=O)cc2)ncc1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.53
SYK P43405 2/20 0.46
AURKA O14965 1/20 0.46
AURKB Q96GD4 1/20 0.46
BRD4 O60885 1/20 0.45
PTK2 Q05397 5/20 0.44
CDK2 P24941 4/20 0.44
CCNT1 O60563 1/20 0.44
CCNB2 O95067 1/20 0.44
CCNE2 O96020 1/20 0.44
CDK1 P06493 1/20 0.44
CCNB1 P14635 1/20 0.44
CCNE1 P24864 1/20 0.44
CDK9 P50750 1/20 0.44
CDK5 Q00535 1/20 0.44
CDK5R1 Q15078 1/20 0.44
CCNB3 Q8WWL7 1/20 0.44
AXL P30530 4/20 0.43
CCNA2 P20248 3/20 0.42
STK4 Q13043 1/20 0.41

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
SCHEMBL2474359 0.91 NTRK1 (0.56) NTRK1SYKAURKAAURKBBRD4
SCHEMBL2473723 0.90 NTRK1 (0.41) NTRK1BRD4PTK2CDK2CDK9
SCHEMBL2470406 0.90 NTRK1 (0.55) NTRK1SYKAURKAAURKBBRD4
SCHEMBL2468711 0.89 NTRK1 (0.55) NTRK1AURKAAURKBPTK2CDK2
SCHEMBL1607751 0.85 BRD4 (0.62) NTRK1BRD4CDK2CDK9AXL
SCHEMBL1607618 0.85 ALK (0.46) NTRK1AURKABRD4PTK2CDK2
SCHEMBL2475717 0.85 BRD4 (0.46) NTRK1SYKAURKABRD4PTK2
SCHEMBL1607687 0.84 PTK2 (0.41) NTRK1AURKABRD4PTK2CDK2
SCHEMBL2470403 0.84 CDK2 (0.53) NTRK1SYKAURKAAURKBBRD4
SCHEMBL2474747 0.83 BRD4 (0.58) NTRK1SYKAURKAAURKBBRD4

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 4361/4885SYK 62/4885AURKA 751/4885
US-20120301486-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 NTRK1 4361/4885SYK 62/4885AURKA 751/4885

“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.