SCHEMBL2061968

SCHEMBL2061968

CS(=O)(=O)Nc1ccccc1Nc1nc(Nc2ccc3c(c2)CNCCS3(=O)=O)ncc1Cl

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 10/20 0.55
FLT3 P36888 2/20 0.55
MET P08581 3/20 0.53
EGFR P00533 8/20 0.51
GLO1 Q04760 1/20 0.49
ROS1 P08922 2/20 0.48
AXL P30530 1/20 0.46

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
SCHEMBL886705 0.82 ALK (0.59) ALKFLT3METEGFRROS1
SCHEMBL886036 0.80 ALK (0.59) ALKFLT3METEGFRROS1
Hydrochloric Acid SCHEMBL2060488 0.80 ALK (0.58) ALKFLT3METEGFRROS1
SCHEMBL885843 0.79 ALK (0.58) ALKFLT3METEGFRGLO1
SCHEMBL29190607 0.76 ALK (0.63) ALKFLT3METEGFRGLO1
SCHEMBL29190526 0.75 ALK (0.57) ALKFLT3METEGFRGLO1
Hydrochloric Acid SCHEMBL29051911 0.74 PTK2 (0.51) ALKFLT3MET
SCHEMBL1039383 0.74 MAPK9 (0.66) ALKFLT3METEGFRGLO1
SCHEMBL29190590 0.74 ALK (0.70) ALKFLT3METEGFRGLO1
SCHEMBL1036294 0.73 ALK (0.68) ALKFLT3METEGFRGLO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 US claimed
US-8148391-B2 Fused bicyclic derivatives of 2,4-diaminopyrimidine as ALK and c-Met inhibitors CEPHALON, INC. (US) 2012-04-03 US disclosed
US-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS CEPHALON, INC. (US) 2009-09-03 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-20090221555-A1 FUSED BICYCLIC DERIVATIVES OF 2,4-DIAMINOPYRIMIDINE AS ALK AND c-MET INHIBITORS ALK, MET, RET ALK 1/4885FLT3 14/4885MET 2/4885

“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.