Bromide

Bromide

SCHEMBL11903065

Cn1cnc([N+](=O)[O-])c1C[N+](C)(C)C/C=C/C(=O)Nc1cc2c(Nc3ccc(Br)c(Cl)c3)ncnc2cn1.[Br-]

nearest known ligand 0.70

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 0.70
ERBB2 P04626 6/20 0.49
ERBB4 Q15303 5/20 0.49
JAK3 P52333 4/20 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
Tarloxotinib SCHEMBL17873943 0.95 EGFR (0.70) EGFRERBB2ERBB4JAK3
Tarloxotinib SCHEMBL11902818 0.95 EGFR (0.70) EGFRERBB2ERBB4JAK3
Tarloxotinib SCHEMBL19733352 0.94 EGFR (0.69) EGFRERBB2ERBB4JAK3
Tarloxotinib SCHEMBL29373183 0.94 EGFR (0.69) EGFRERBB2ERBB4JAK3
Bromide SCHEMBL11902922 0.94 EGFR (0.72) EGFRERBB2ERBB4JAK3
Bromide SCHEMBL11902840 0.94 EGFR (0.68) EGFRERBB2ERBB4JAK3
Bromide SCHEMBL11903184 0.92 EGFR (0.70) EGFRERBB2ERBB4JAK3
Bromide SCHEMBL867357 0.91 EGFR (0.70) EGFRERBB2ERBB4JAK3
Bromide SCHEMBL11903161 0.91 EGFR (0.67) EGFRERBB2ERBB4JAK3
Bromide SCHEMBL11902843 0.90 EGFR (0.57) EGFRERBB2ERBB4JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2016-02-04 US claimed
US-9101632-B2 Kinase inhibitors, prodrug forms thereof and their use in therapy AUCKLAND UNISERVICES LIMITED (NZ) 2015-08-11 US claimed
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-08-09 US claimed
US-20210346383-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING HER-DRIVEN CANCERS RAIN THERAPEUTICS INC. 2021-11-11 US disclosed
US-20200268759-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING HER-DRIVEN DRUG-RESISTANT CANCERS THE REGENTS OF THE UNIVERSITY OF COLORADO 2020-08-27 US disclosed
US-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2016-02-04 US disclosed
US-9101632-B2 Kinase inhibitors, prodrug forms thereof and their use in therapy AUCKLAND UNISERVICES LIMITED (NZ) 2015-08-11 US disclosed
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY AUCKLAND UNISERVICES LIMITED (NZ) 2012-08-09 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 (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-20160031877-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY ERBB2, MAP3K3, ERBB3 EGFR 110/4885ERBB2 1/4885ERBB4 50/4885
US-20200268759-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING HER-DRIVEN DRUG-RESISTANT CANCERS EGFR, BRCA1, ERBB2 EGFR 1/4885ERBB2 3/4885ERBB4 14/4885
US-20120202832-A1 KINASE INHIBITORS, PRODRUG FORMS THEREOF AND THEIR USE IN THERAPY ERBB2, MAP3K3, MAP3K19 EGFR 110/4885ERBB2 1/4885ERBB4 55/4885
US-20210346383-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING HER-DRIVEN CANCERS EGFR, VHL, MYC EGFR 1/4885ERBB2 7/4885ERBB4 22/4885

“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.