Bromide

Bromide

SCHEMBL2992035

Br.Oc1cccc2c1OCCNC2

nearest known ligand 0.51

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 5)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 18/20 0.43
SSTR1 P30872 4/20 0.39
SSTR2 P30874 4/20 0.39
SSTR3 P32745 4/20 0.39
SSTR5 P35346 4/20 0.39

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
SCHEMBL2994306 0.98 SSTR4 (0.44) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL4343351 0.84 SSTR4 (0.41) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL13738797 0.77 SSTR4 (0.41) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL22513280 0.77 SSTR4 (0.46) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL20565286 0.77 SSTR4 (0.47) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL31170845 0.77 HTR2C (0.48) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL19582237 0.77 CD44 (0.51) SSTR4SSTR1SSTR2SSTR3SSTR5
Trifluoroacetic Acid SCHEMBL3277737 0.74 SSTR4 (0.43) SSTR4SSTR1SSTR2SSTR3SSTR5
Hydrochloric Acid SCHEMBL3276373 0.74 SSTR4 (0.54) SSTR4SSTR1SSTR2SSTR3SSTR5
SCHEMBL2052908 0.74 PARP1 (0.56)

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-2222669-B1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) GLAXO GROUP LTD (GB) 2013-08-21 EP disclosed
US-8222245-B2 Oxadiazole derivatives active on sphingosine-1-phosphate (S1P) GLAXO GROUP LIMITED (GB) 2012-07-17 US disclosed
US-20100273771-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) GLAXO GROUP LIMITED (GB) 2010-10-28 US disclosed
EP-2222669-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) Glaxo Group Limited (GB) 2010-09-01 EP disclosed
US-20100174065-A1 COMPOUNDS GLAXO GROUP LIMITED (US) 2010-07-08 US disclosed
WO-2009080725-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) GLAXO GROUP LIMITED (GB) 2009-07-02 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 (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-20100174065-A1 COMPOUNDS CYP11B2, CYP11B1, GLS2 SSTR4 2703/4885SSTR1 3400/4885SSTR2 2070/4885
US-20100273771-A1 OXADIAZOLE DERIVATIVES ACTIVE ON SPHINGOSINE-1-PHOSPHATE (SIP) S1PR3, S1PR1, S1PR2 SSTR4 1058/4885SSTR1 876/4885SSTR2 734/4885

“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.