Bromide

Bromide

SCHEMBL5203588

Br.CC(C)(C)[C@H](N)C(=O)N1C[C@@H](F)C[C@H]1C#N.O

nearest known ligand 0.73

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
DPP4 P27487 20/20 0.73
FAP Q12884 6/20 0.73
DPP7 Q9UHL4 6/20 0.58
DPP8 Q6V1X1 2/20 0.57
DPP9 Q86TI2 2/20 0.57

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
SCHEMBL5206538 0.99 DPP4 (0.74) DPP4FAPDPP7DPP8DPP9
Hydrochloric Acid SCHEMBL1082946 0.97 DPP4 (0.73) DPP4FAPDPP7DPP8DPP9
SCHEMBL20693851 0.88 DPP4 (0.71) DPP4FAPDPP7DPP8DPP9
SCHEMBL20693833 0.88 DPP4 (0.71) DPP4FAPDPP7DPP8DPP9
Hydrochloric Acid SCHEMBL6070181 0.86 DPP4 (0.70) DPP4FAPDPP7DPP8DPP9
SCHEMBL5550719 0.84 DPP4 (1.00) DPP4FAPDPP7
SCHEMBL6754510 0.83 DPP4 (0.76) DPP4FAPDPP7DPP8DPP9
SCHEMBL5202315 0.83 DPP4 (0.76) DPP4FAPDPP7DPP8DPP9
Hydrochloric Acid SCHEMBL5207093 0.82 DPP4 (0.74) DPP4FAPDPP7DPP8DPP9
SCHEMBL3164958 0.81 DPP4 (0.73) DPP4FAPDPP7DPP8DPP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070112059-A1 CYANOPYRROLIDINE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. 2007-05-17 US disclosed
US-20070112205-A1 CYANOPYRROLIDINE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. 2007-05-17 US disclosed
EP-1746086-A1 Cyanopyrrolidine derivatives TAISHO PHARMACEUTICAL CO., LTD (JP) 2007-01-24 EP disclosed
US-20040072892-A1 Cyanopyrrolidine derivatives TAISHO PHARMACEUTICAL CO., LTD. (JP) 2004-04-15 US disclosed
EP-1333025-A1 CYANOPYRROLIDINE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD (JP) 2003-08-06 EP 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 (3 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-20040072892-A1 Cyanopyrrolidine derivatives CCR9, OPRD1, CBR1 DPP4 2412/4885FAP 3334/4885DPP7 3078/4885
US-20070112059-A1 CYANOPYRROLIDINE DERIVATIVES DPP4, DPP9, DPP3 DPP4 1/4885FAP 40/4885DPP7 4/4885
US-20070112205-A1 CYANOPYRROLIDINE DERIVATIVES CBR3, CBR1, TERT DPP4 3721/4885FAP 2348/4885DPP7 4451/4885

“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.