SCHEMBL21070592

SCHEMBL21070592

COc1ccc(Nc2nc(Nc3cc(OCCOCCOCCOCCOCCNC(=O)O)c(OC)cc3C)ncc2Cl)c(NS(C)(=O)=O)c1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 3/20 0.48
ROS1 P08922 2/20 0.48
MAPK3 P27361 2/20 0.47
EGFR P00533 15/20 0.46
MET P08581 1/20 0.45
LRRK2 Q5S007 1/20 0.45

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
SCHEMBL31664109 0.93 ALK (0.48) ALKROS1MAPK3EGFRMET
SCHEMBL21069298 0.93 ALK (0.48) ALKROS1MAPK3EGFRMET
SCHEMBL31664262 0.91 ALK (0.47) ALKROS1MAPK3EGFRMET
SCHEMBL21069849 0.91 ALK (0.47) ALKROS1MAPK3EGFRMET
SCHEMBL21070683 0.90 ALK (0.50) ALKROS1MAPK3EGFRMET
SCHEMBL31664188 0.90 ALK (0.50) ALKROS1MAPK3EGFRMET
SCHEMBL21071950 0.89 ALK (0.47) ALKROS1MAPK3EGFRMET
SCHEMBL1706869 0.89 ALK (0.52) ALKROS1MAPK3EGFRMET
SCHEMBL21070436 0.88 ALK (0.46) ALKROS1MAPK3EGFRMET
SCHEMBL31664087 0.88 ALK (0.46) ALKROS1MAPK3EGFRMET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-12-14 US disclosed
US-11723980-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2023-08-15 US disclosed
US-20230106066-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-04-06 US disclosed
US-11318205-B1 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2022-05-03 US disclosed
US-10874743-B2 IRAK degraders and uses thereof KYMERA THERAPEUTICS, INC. (US) 2020-12-29 US disclosed
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2019-06-27 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-10874743-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ALK 83/4885ROS1 1084/4885MAPK3 1422/4885
US-20230106066-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALK 83/4885ROS1 1084/4885MAPK3 1422/4885
US-11723980-B2 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ALK 83/4885ROS1 1084/4885MAPK3 1422/4885
US-20230398223-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALK 83/4885ROS1 1084/4885MAPK3 1422/4885
US-20190192668-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALK 83/4885ROS1 1084/4885MAPK3 1422/4885
US-11318205-B1 IRAK degraders and uses thereof IRAK2, IRAK3, IRAK1 ALK 83/4885ROS1 1084/4885MAPK3 1422/4885

“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.