SCHEMBL23683386

SCHEMBL23683386

COc1ccc(-c2cnc3ccc(NCc4ccc(S(=O)(=O)NC(C)(C)C)cc4)nn23)cc1OC

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FYN P06241 17/20 0.61
PIM1 P11309 1/20 0.51
PIK3CG P48736 1/20 0.50
NTRK1 P04629 1/20 0.49
NTRK3 Q16288 1/20 0.49
NTRK2 Q16620 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
SCHEMBL1053021 0.88 FYN (0.68) FYNPIK3CGNTRK1NTRK3NTRK2
SCHEMBL24828752 0.87 FYN (0.61) FYNPIM1PIK3CGNTRK1NTRK3
SCHEMBL23683388 0.85 FYN (0.68) FYNPIM1PIK3CG
SCHEMBL23683338 0.82 FYN (0.76) FYNPIK3CGNTRK1NTRK3NTRK2
SCHEMBL1054612 0.81 FYN (0.78) FYNPIK3CGNTRK1NTRK3NTRK2
SCHEMBL2946495 0.79 FYN (0.64) FYNPIM1PIK3CGNTRK1NTRK3
SCHEMBL13234355 0.78 MKNK1 (0.62) FYNNTRK1NTRK3NTRK2
SCHEMBL1052973 0.76 FYN (1.00) FYNPIM1PIK3CG
SCHEMBL30521897 0.76 FYN (1.00) FYN
SCHEMBL18613318 0.76 FYN (1.00) FYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11542251-B2 IRAK degraders and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-01-03 US disclosed
US-20210230144-A1 IRAK DEGRADERS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2021-07-29 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-11542251-B2 IRAK degraders and uses thereof IRAK2, IRAK1, IRAK4 FYN 1032/4885PIM1 440/4885PIK3CG 1134/4885
US-20210230144-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK1, IRAK4 FYN 1032/4885PIM1 440/4885PIK3CG 1134/4885

“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.