Bromide

Bromide

SCHEMBL3600548

Clc1cc(N2CCOCC2)nc(C[P+](c2ccccc2)(c2ccccc2)c2ccccc2)n1.[Br-]

nearest known ligand 0.49

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 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.49
CYP1A2 P05177 2/20 0.49
CYP2D6 P10635 1/20 0.49
KMT2A Q03164 4/20 0.46
HTT P42858 3/20 0.46
PIK3CB P42338 4/20 0.43
TSHR P16473 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
GAA P10253 1/20 0.42
HPGD P15428 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 2/20 0.42
LMNA P02545 1/20 0.42
RAF1 P04049 1/20 0.41
BRAF P15056 1/20 0.41
PIK3CA P42336 1/20 0.41

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
SCHEMBL3607480 0.80 MAPT (0.51) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL913203 0.76 MAPT (0.49) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL3604836 0.76 PIK3CB (0.57) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL13119724 0.75 MAPT (0.48) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL3599828 0.74 CYP1A2 (0.60) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL3601715 0.74 MAPT (0.65) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL3598467 0.74 MAPT (0.60) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL13141217 0.74 MAPT (0.60) MAPTCYP1A2CYP2D6KMT2AHTT
SCHEMBL18398994 0.74 CYP1A2 (0.60) MAPTCYP1A2CYP2D6KMT2AHTT
Bromide SCHEMBL17076470 0.74 PDE10A (0.49) MAPTKMT2AHTTPIK3CBTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100256143-A1 PHARMACEUTICAL COMPOUNDS BAKER STEWART JAMES 2010-10-07 US disclosed
EP-2146981-A1 PHARMACEUTICAL COMPOUNDS F. Hoffmann-Roche AG (CH) 2010-01-27 EP disclosed
WO-2008125833-A1 PHARMACEUTICAL COMPOUNDS PIRAMED LIMITED (GB) 2008-10-23 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 (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-20100256143-A1 PHARMACEUTICAL COMPOUNDS PIK3CA, PIK3CD, JAK2 MAPT 2195/4885CYP1A2 1185/4885CYP2D6 1107/4885

“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.