SCHEMBL21296583

SCHEMBL21296583

O=C(CBr)Nc1cccc2ncccc12

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.74
LMNA P02545 2/20 0.74
HTT P42858 2/20 0.74
SMN1; SMN2 Q16637 2/20 0.74
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
RECQL P46063 1/20 0.61
KDM4E B2RXH2 2/20 0.60
MAPT P10636 1/20 0.60
CLK1 P49759 1/20 0.60
P2RX7 Q99572 1/20 0.60
HDAC6 Q9UBN7 1/20 0.58
PABPC1 P11940 3/20 0.57
EIF4H Q15056 3/20 0.57
L3MBTL1 Q9Y468 2/20 0.57
RAB9A P51151 1/20 0.55
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54

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
SCHEMBL21296571 0.89 PTPN1 (0.60) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL4861658 0.88 ALDH1A1 (0.70) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL8402846 0.85 ALDH1A1 (0.74) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL29728211 0.85 ALDH1A1 (1.00) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL4865337 0.85 ALDH1A1 (1.00) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL6030648 0.85 ALDH1A1 (0.74) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL6030652 0.85 ALDH1A1 (0.74) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL27617527 0.85 ALDH1A1 (0.74) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL3319628 0.84 ALDH1A1 (0.64) ALDH1A1LMNAHTTSMN1; SMN2MEN1
SCHEMBL2639029 0.82 ALDH1A1 (0.70) ALDH1A1LMNAHTTSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11999731-B2 EGFR dimer disruptors and use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2024-06-04 US disclosed
US-20220340572-A1 EGFR DIMER DISRUPTORS AND USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2022-10-27 US disclosed
US-11358965-B2 EGFR dimer disruptors and use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2022-06-14 US disclosed
EP-3755323-A1 EGFR DIMER DISRUPTORS AND USE OF THE SAME The Regents Of The University Of Michigan (US) 2020-12-30 EP disclosed
US-20200377503-A1 EGFR DIMER DISRUPTORS AND USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2020-12-03 US disclosed
CN-111886009-A EGFR dimer disruptors and uses thereof 密歇根大学董事会 2020-11-03 CN disclosed
WO-2019165358-A1 EGFR DIMER DISRUPTORS AND USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-08-29 WO 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 (4 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-11358965-B2 EGFR dimer disruptors and use of the same EGFR, ERBB2, ERBB4 ALDH1A1 4429/4885LMNA 4402/4885HTT 3104/4885
US-20220340572-A1 EGFR DIMER DISRUPTORS AND USE OF THE SAME EGFR, ERBB2, ERBB4 ALDH1A1 4429/4885LMNA 4402/4885HTT 3104/4885
US-11999731-B2 EGFR dimer disruptors and use of the same EGFR, ERBB2, ERBB4 ALDH1A1 4429/4885LMNA 4402/4885HTT 3104/4885
US-20200377503-A1 EGFR DIMER DISRUPTORS AND USE OF THE SAME EGFR, ERBB2, ERBB4 ALDH1A1 4429/4885LMNA 4402/4885HTT 3104/4885

“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.