Bromide

Bromide

SCHEMBL20920184

Br.Br.N=C(N)SCc1cccc(F)c1CSC(=N)N

nearest known ligand 0.67

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 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.67
HTT P42858 4/20 0.53
HPGD P15428 2/20 0.53
IDO1 P14902 8/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
LMNA P02545 3/20 0.51
TAAR1 Q96RJ0 2/20 0.51
SLC11A2 P49281 2/20 0.51
ATP1A1 P05023 1/20 0.50
ATP1B1 P05026 1/20 0.50
ATP1A3 P13637 1/20 0.50
ATP1B2 P14415 1/20 0.50
ATP1A2 P50993 1/20 0.50
ATP1B3 P54709 1/20 0.50
FXYD2 P54710 1/20 0.50
ATP1A4 Q13733 1/20 0.50
NOS1 P29475 2/20 0.46
NOS3 P29474 1/20 0.46
NOS2 P35228 1/20 0.46
TP53 P04637 2/20 0.45

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
SCHEMBL22275785 0.98 BACE1 (0.69) BACE1HTTHPGDIDO1SMN1; SMN2
SCHEMBL13007602 0.88 BACE1 (0.77) BACE1HTTHPGDIDO1SMN1; SMN2
Hydrochloric Acid SCHEMBL2891486 0.86 BACE1 (0.75) BACE1HTTHPGDIDO1SMN1; SMN2
Bromide SCHEMBL3595630 0.85 BACE1 (0.55) BACE1HTTHPGDIDO1SMN1; SMN2
Bromide SCHEMBL4919108 0.84 IDO1 (0.61) BACE1HTTHPGDIDO1SMN1; SMN2
SCHEMBL13007585 0.82 IDO1 (0.62) BACE1HTTHPGDIDO1SMN1; SMN2
SCHEMBL3681446 0.80 HTT (0.61) BACE1HTTHPGDIDO1SMN1; SMN2
Bromide SCHEMBL4445136 0.78 HTT (0.62) HTTHPGDIDO1SMN1; SMN2LMNA
Bromide SCHEMBL2810146 0.78 IDO1 (0.71) HTTHPGDIDO1SMN1; SMN2LMNA
SCHEMBL3690551 0.76 HTT (0.65) HTTHPGDIDO1SMN1; SMN2LMNA

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-20250092020-A1 IDO/TDO Inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-03-20 US disclosed
US-12209079-B2 IDO/TDO inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-01-28 US disclosed
US-20220380305-A1 IDO/TDO Inhibitor CANBAS CO., LTD. 2022-12-01 US disclosed
US-20200239452-A1 IDO/TDO Inhibitor CANBAS CO., LTD. (JP) 2020-07-30 US disclosed
WO-2019078246-A1 IDO/TDO INHIBITOR 一般社団法人ファルマバレープロジェクト支援機構 2019-04-25 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 (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-12209079-B2 IDO/TDO inhibitor IDO1, IDO2, TDO2 BACE1 320/4885HTT 71/4885HPGD 1152/4885
US-20200239452-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 BACE1 320/4885HTT 71/4885HPGD 1152/4885
US-20250092020-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 BACE1 320/4885HTT 71/4885HPGD 1152/4885
US-20220380305-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 BACE1 760/4885HTT 100/4885HPGD 1303/4885

“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.