SCHEMBL21958599

SCHEMBL21958599

CNC(=O)c1cn(O)c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PLK1 P53350 3/20 0.58
▸ BRD4 O60885 1/20 0.55
▸ KDM4E B2RXH2 1/20 0.54
▸ L3MBTL1 Q9Y468 1/20 0.54
▸ PTPN7 P35236 1/20 0.53
▸ NR4A2 P43354 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ CNR1 P21554 1/20 0.47
▸ EGFR P00533 2/20 0.45
▸ SRC P12931 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ GAA P10253 1/20 0.44
▸ CREBBP Q92793 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL1093252 0.83 BRD4 (0.69) PLK1BRD4KDM4EL3MBTL1PTPN7
SCHEMBL28068133 0.81 PLK1 (0.57) PLK1BRD4KDM4EL3MBTL1PTPN7
SCHEMBL20674165 0.80 SMN1; SMN2 (0.55) BRD4L3MBTL1LMNAPOLBCREBBP
SCHEMBL30117222 0.79 LMNA (0.74) PLK1BRD4L3MBTL1PTPN7NR4A2
SCHEMBL10596904 0.78 KDM4E (0.50) KDM4EL3MBTL1NR4A2LMNACNR1
SCHEMBL14118735 0.78 ALDH1A1 (0.50) PLK1KDM4ELMNAPOLBHTT
SCHEMBL19234284 0.76 PTPN7 (0.61) PLK1BRD4KDM4EL3MBTL1PTPN7
SCHEMBL13837161 0.76 KMT2A (0.69) PLK1KDM4EPTPN7LMNACNR1
SCHEMBL10341234 0.76 KDM4E (0.72) BRD4KDM4EL3MBTL1NR4A2LMNA
SCHEMBL8999130 0.74 PLK1 (1.00) PLK1LMNAMEN1KMT2A

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
EP-3399968-B1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS PHARMATECH LTD (KY) 2021-10-20 — — EP disclosed
US-20200131176-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE CS PHARMATECH LIMITED (KY) 2020-04-30 — — 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 (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-20200131176-A1 SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE EGFR, ERBB3, ERBB2 PLK1 322/4885BRD4 2555/4885KDM4E 1912/4885

“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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