SCHEMBL1474909

SCHEMBL1474909

CNS(=O)(=O)c1cccc(Nc2ncc(C)c(Nc3ccc4c(c3)CCC(=O)N4C)n2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 4/20 0.56
INSR P06213 3/20 0.56
JAK3 P52333 11/20 0.55
JAK1 P23458 10/20 0.55
BRD4 O60885 9/20 0.55
JAK2 O60674 3/20 0.55
BRDT Q58F21 3/20 0.55
RET P07949 2/20 0.55
WEE1 P30291 2/20 0.55
FLT3 P36888 2/20 0.55
BUB1B O60566 1/20 0.55
BRD2 P25440 1/20 0.55
BRD3 Q15059 1/20 0.55
EGFR P00533 2/20 0.51
BTK Q06187 2/20 0.51
TNNI3K Q59H18 2/20 0.49
SYK P43405 2/20 0.49
BMPR1B O00238 1/20 0.49
PLK4 O00444 1/20 0.49
STK25 O00506 1/20 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
SCHEMBL1476719 0.91 BRD4 (0.53) ALKINSRJAK3JAK1BRD4
SCHEMBL1477051 0.91 BRD4 (0.68) ALKINSRJAK3JAK1BRD4
SCHEMBL1475032 0.91 INSR (0.68) ALKINSRJAK1BRD4JAK2
SCHEMBL1474907 0.90 JAK3 (0.65) ALKINSRJAK3JAK1BRD4
SCHEMBL1476372 0.90 BRD4 (0.68) ALKINSRJAK3JAK1BRD4
SCHEMBL1476581 0.88 INSR (0.59) ALKINSRJAK3JAK1BRD4
SCHEMBL1474126 0.84 JAK3 (0.56) ALKINSRJAK3JAK1BRD4
SCHEMBL1475561 0.82 BRD4 (0.51) ALKINSRJAK3JAK1BRD4
SCHEMBL1198275 0.82 INSR (0.62) ALKINSRJAK1BRD4JAK2
SCHEMBL1474612 0.82 INSR (0.60) ALKINSRJAK3JAK1BRD4

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
US-20080221089-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-09-11 US claimed
US-20070203161-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2007-08-30 US claimed
US-11667611-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2023-06-06 US disclosed
US-20190256476-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2019-08-22 US disclosed
US-20170121291-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2017-05-04 US disclosed
US-9593082-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2017-03-14 US disclosed
US-7915273-B2 Compositions and methods for inhibition of the JAK pathway RIGEL PHARMACEUTICALS, INC. (US) 2011-03-29 US disclosed
US-20100152218-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. (US) 2010-06-17 US disclosed
US-20080221089-A1 Prevent transplant rejection; autoimmune diseases RIGEL PHARMACEUTICALS, INC. 2008-09-11 US disclosed
US-20070203161-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY RIGEL PHARMACEUTICALS, INC. 2007-08-30 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 (6 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-11667611-B2 Compositions and methods for inhibition of the JAK pathway JAK3, JAK2, JAK1 ALK 557/4885INSR 2315/4885JAK3 1/4885
US-20170121291-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 ALK 557/4885INSR 2315/4885JAK3 1/4885
US-20190256476-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 ALK 557/4885INSR 2315/4885JAK3 1/4885
US-20070203161-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 ALK 557/4885INSR 2315/4885JAK3 1/4885
US-20080221089-A1 Prevent transplant rejection; autoimmune diseases JAK3, JAK1, JAK2 ALK 3175/4885INSR 1361/4885JAK3 1/4885
US-20100152218-A1 COMPOSITIONS AND METHODS FOR INHIBITION OF THE JAK PATHWAY JAK3, JAK2, JAK1 ALK 557/4885INSR 2315/4885JAK3 1/4885

“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.