Bromide

Bromide

SCHEMBL2810299

Br.Br.N=C(N)SCc1ccc2ccccc2c1CSC(=N)N

nearest known ligand 0.64

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
HTT P42858 6/20 0.64
HPGD P15428 3/20 0.64
SMN1; SMN2 Q16637 5/20 0.55
TP53 P04637 2/20 0.55
CYP3A4 P08684 2/20 0.55
CYP1A2 P05177 1/20 0.55
CYP2D6 P10635 1/20 0.55
HIF1A Q16665 1/20 0.55
MAPT P10636 3/20 0.54
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 2/20 0.54
HSD17B10 Q99714 1/20 0.54
IDO1 P14902 8/20 0.51
LMNA P02545 2/20 0.50
TAAR1 Q96RJ0 2/20 0.50
SLC11A2 P49281 2/20 0.50
ATP1A1 P05023 1/20 0.49
ATP1B1 P05026 1/20 0.49
ATP1A3 P13637 1/20 0.49
ATP1B2 P14415 1/20 0.49

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
SCHEMBL2813545 0.98 HTT (0.66) HTTHPGDSMN1; SMN2TP53CYP3A4
SCHEMBL13994610 0.88 HTT (0.60) HTTHPGDSMN1; SMN2TP53CYP3A4
SCHEMBL11940549 0.84 HTT (0.56) HTTHPGDSMN1; SMN2TP53CYP3A4
Bromide SCHEMBL4438773 0.82 HTT (0.57) HTTHPGDSMN1; SMN2TP53CYP3A4
SCHEMBL14355160 0.81 SMN1; SMN2 (0.65) HTTHPGDSMN1; SMN2TP53CYP3A4
SCHEMBL14355157 0.81 HTT (0.64) HTTHPGDSMN1; SMN2TP53CYP3A4
SCHEMBL3687722 0.80 HTT (0.58) HTTHPGDSMN1; SMN2TP53CYP3A4
SCHEMBL13779244 0.80 HTT (0.96) HTTHPGDSMN1; SMN2TP53CYP3A4
Pseudourea SCHEMBL29426454 0.79 SMN1; SMN2 (0.82) HTTHPGDSMN1; SMN2TP53CYP3A4
Bromide SCHEMBL4920739 0.77 HTT (0.48) HTTHPGDSMN1; SMN2TP53CYP3A4

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 7 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
US-20100240713-A1 AROMATIC AND HETEROAROMATIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2010-09-23 US disclosed
EP-2068855-A2 AROMATIC AND HETEROAROMATIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2009-06-17 EP disclosed
WO-2008151288-A2 AROMATIC AND HETEROAROMATIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS XENON PHARMACEUTICALS INC. (CA) 2008-12-11 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 (5 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 HTT 71/4885HPGD 1152/4885SMN1; SMN2 1967/4885
US-20200239452-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 HTT 71/4885HPGD 1152/4885SMN1; SMN2 1967/4885
US-20250092020-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 HTT 71/4885HPGD 1152/4885SMN1; SMN2 1967/4885
US-20220380305-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 HTT 100/4885HPGD 1303/4885SMN1; SMN2 2109/4885
US-20100240713-A1 AROMATIC AND HETEROAROMATIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS SLC40A1, PAH, FECH HTT 311/4885HPGD 740/4885SMN1; SMN2 2035/4885

“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.