Bromide

Bromide

SCHEMBL1732482

Br.CCC(C(=O)O)C1CN(C)c2cc(C(=O)CN3Cc4ccc(C5CC5)nc4C3=N)cc(C(C)(C)C)c2O1

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

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 1)

geneUniProtsupporting neighboursconfidence
F2R P25116 6/20 0.34

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
Bromide SCHEMBL1732487 0.86 F2R (0.35) F2R
Bromide SCHEMBL1732511 0.85 F2R (0.39) F2R
Bromide SCHEMBL5494493 0.83 F2R (0.34) F2R
Bromide SCHEMBL1729506 0.82 F2R (0.38) F2R
Bromide SCHEMBL1729648 0.81 F2R (0.40) F2R
Hydrochloric Acid SCHEMBL1732787 0.80 F2R (0.39) F2R
Bromide SCHEMBL1732842 0.79 F2R (0.35) F2R
Bromide SCHEMBL5483188 0.78 F2R (0.35) F2R
Bromide SCHEMBL1732601 0.78 F2R (0.36) F2R
SCHEMBL14449091 0.78 F2R (0.41) F2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1973407-B1 SPIRO COMPOUNDS AND METHODS OF USE CHEN GUOQING PAUL (US) 2011-11-23 EP disclosed
US-20110237794-A1 Spiro Compounds And Methods Of Use CHEN GUOQING PAUL 2011-09-29 US disclosed
US-7977346-B2 Spiro compounds and methods of use CHEN GUOQING PAUL 2011-07-12 US disclosed
EP-1973407-A2 SPIRO COMPOUNDS AND METHODS OF USE Chen, Guoqing Paul (US) 2008-10-01 EP disclosed
WO-2007084875-A2 SPIRO COMPOUNDS AND METHODS OF USE CHEN GUOQING PAUL (US) 2007-07-26 WO disclosed
US-20070167470-A1 Spiro compounds and methods of use CHEN GUOQING P 2007-07-19 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-20110237794-A1 Spiro Compounds And Methods Of Use TEK, KDR, EGFR F2R 1775/4885
US-20070167470-A1 Spiro compounds and methods of use TEK, KDR, EGFR F2R 1775/4885

“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.