SCHEMBL26379941

SCHEMBL26379941

CCOc1cnc(Nc2cc(CC)c(N3CCC(N4CCN(C)CC4)CC3)nc2OC)nc1Nc1ccc2nccnc2c1N(C)S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 14/20 0.53
▸ MET P08581 1/20 0.49
▸ ALK Q9UM73 6/20 0.44
▸ INSR P06213 5/20 0.44
▸ IGF1R P08069 5/20 0.44

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
SCHEMBL26379932 0.96 EGFR (0.56) EGFRMETALKINSRIGF1R
SCHEMBL26379893 0.94 EGFR (0.54) EGFRMETALKINSRIGF1R
SCHEMBL26379916 0.93 EGFR (0.52) EGFRMETALKINSRIGF1R
SCHEMBL26379773 0.93 EGFR (0.53) EGFRMETALKINSRIGF1R
SCHEMBL26379435 0.92 EGFR (0.52) EGFRMETALKINSRIGF1R
SCHEMBL26378906 0.92 EGFR (0.57) EGFRMETALKINSRIGF1R
SCHEMBL26378843 0.92 EGFR (0.62) EGFRMET
SCHEMBL25789270 0.92 EGFR (0.52) EGFRMETALKINSRIGF1R
SCHEMBL26379745 0.92 EGFR (0.52) EGFRMETALKINSRIGF1R
SCHEMBL26403955 0.91 EGFR (0.55) EGFRALKINSRIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230310428-A1 EGFR INHIBITOR AND PREPARATION METHOD AND USE THEREOF Hongyun Biotech Co., Ltd. (CN) 2023-10-05 — — 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-20230310428-A1 EGFR INHIBITOR AND PREPARATION METHOD AND USE THEREOF EGFR, ERBB2, ERBB4 EGFR 1/4885MET 9/4885ALK 58/4885

“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.

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