Bromide

Bromide

SCHEMBL2885802

Br.Cn1nc(C(F)(F)F)c(CSC(=N)N)c1OC(F)F

nearest known ligand 0.34

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
IDO1 P14902 4/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
SLC11A2 P49281 1/20 0.32
MPO P05164 1/20 0.32
CYP1A2 P05177 3/20 0.32
CYP2C19 P33261 2/20 0.32
CYP2D6 P10635 2/20 0.32
BACE1 P56817 1/20 0.32
GAA P10253 1/20 0.32
CYP2C9 P11712 1/20 0.31
ATP1A1 P05023 1/20 0.31
ATP1B1 P05026 1/20 0.31
ATP1A3 P13637 1/20 0.31
ATP1B2 P14415 1/20 0.31
ATP1A2 P50993 1/20 0.31
ATP1B3 P54709 1/20 0.31
FXYD2 P54710 1/20 0.31
ATP1A4 Q13733 1/20 0.31

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
SCHEMBL23782624 0.99 IDO1 (0.35) IDO1MEN1KMT2ASMN1; SMN2SLC11A2
Hydrochloric Acid SCHEMBL5388643 0.98 IDO1 (0.36) IDO1MEN1KMT2ASMN1; SMN2SLC11A2
SCHEMBL25907574 0.87 MEN1 (0.32) MEN1KMT2ASMN1; SMN2MPO
Bromide SCHEMBL5382276 0.86 IDO1 (0.33) IDO1SLC11A2CYP1A2CYP2C19CYP2D6
Bromide SCHEMBL5373790 0.86 IDO1 (0.33) IDO1SLC11A2CYP1A2CYP2C19CYP2D6
Bromide SCHEMBL5374112 0.86 IDO1 (0.33) IDO1MEN1KMT2ASMN1; SMN2SLC11A2
SCHEMBL28755298 0.84 IDO1 (0.33) IDO1MEN1KMT2ASMN1; SMN2SLC11A2
Bromide SCHEMBL5382542 0.84 IDO1 (0.35) IDO1MEN1KMT2ASMN1; SMN2SLC11A2
SCHEMBL24179946 0.83 MEN1 (0.30) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19
SCHEMBL22939563 0.82 MEN1 (0.39) MEN1KMT2ASMN1; SMN2CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260022113-A1 Process for the Preparation of Pyroxasulfone ATTICUS LLC (US) 2026-01-22 US disclosed
US-20250361225-A1 A PROCESS FOR PREPARATION OF 3-[5-(DIFLUOROMETHOXY)-1- METHYL-3-(TRIFLUOROMETHYL)PYRAZOL-4- YLMETHYLSULFONYL]-4,5-DIHYDRO-5,5-DIMETHYL-1,2-OXAZOLE AND ITS INTERMEDIATES UPL LTD (IN) 2025-11-27 US disclosed
WO-2023194957-A1 A PROCESS FOR PREPARATION OF 3-[5-(DIFLUOROMETHOXY)-1- METHYL-3-(TRIFLUOROMETHYL)PYRAZOL-4- YLMETHYLSULFONYL]-4,5-DIHYDRO-5,5-DIMETHYL-1,2-OXAZOLE AND ITS INTERMEDIATES UPL LIMITED (IN) 2023-10-12 WO disclosed
CN-114716379-A Preparation method of topramezone intermediate 绍兴贝斯美化工股份有限公司 2022-07-08 CN disclosed
EP-2227458-B1 Chiral 2-(Benzylsulfinyl)-thiazol derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]-thiazol derivatives with S-configuration as herbicide plant growth regulators BAYER IP GMBH (DE) 2016-06-22 EP disclosed
EP-1541561-B1 PYRAZOLE DERIVATIVES AND PROCESS FOR THE PRODUCTION THEREOF IHARA CHEMICAL IND CO (JP) 2014-07-23 EP disclosed
US-8754234-B2 Chiral 2-(benzylsulfinyl)thiazole derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]thiazole derivatives, processes for their preparation and their use as herbicides and plant growth regulators BAYER CROPSCIENCE AG (DE) 2014-06-17 US disclosed
US-20100285958-A1 Chiral 2-(benzylsulfinyl)Thiazole derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]thiazole derivatives, processes for their preparation and their use as herbicides and plant growth regulators BAYER INTELLECTUAL PROPERTY GMBH (DE) 2010-11-11 US disclosed
EP-2227458-A2 2-(BENZYL- AND 1H-PYRAZOL-4-YLMETHYL)SULFINYL-THIAZOL-DERIVATIVES AS HERBICIDES AND PLANT GROWTH REGULATORS Bayer CropScience AG (DE) 2010-09-15 EP disclosed
WO-2009068170-A2 2-(BENZYL- AND 1H-PYRAZOL-4-YLMETHYL)SULFINYL THIAZOLE DERIVATIVES AS HERBICIDES AND PLANT GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2009-06-04 WO disclosed
EP-2065374-A1 2-(benzyl- and 1H-pyrazol-4-ylmethyl)sulfinyl-thiazol-derivatives as herbicides and plant growth regulators Bayer CropScience AG (DE) 2009-06-03 EP disclosed
US-20070249844-A1 Pyrazole derivatives and process for the production thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-10-25 US disclosed
US-7256298-B2 Pyrazole derivatives and process for the production thereof IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 2007-08-14 US disclosed
US-20070015805-A1 Process for preparing 3-arylmethylthio- and 3-heteroarylmethylthio-4,5-dihydroisoxazoline derivatives BAYER CROPSCIENCE GMBH (DE) 2007-01-18 US disclosed
US-20050215797-A1 Pyrazole derivatives and process for the production thereof KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2005-09-29 US disclosed
EP-1541561-A1 PYRAZOLE DERIVATIVES AND PROCESS FOR THE PRODUCTION THEREOF IHARA CHEMICAL INDUSTRY Co., Ltd. (JP) 2005-06-15 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 (6 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-20250361225-A1 A PROCESS FOR PREPARATION OF 3-[5-(DIFLUOROMETHOXY)-1- METHYL-3-(TRIFLUOROMETHYL)PYRAZOL-4- YLMETHYLSULFONYL]-4,5-DIHYDRO-5,5-DIMETHYL-1,2-OXAZOLE AND ITS INTERMEDIATES DHPS, DHODH, FIS1 IDO1 596/4885MEN1 1388/4885KMT2A 437/4885
US-20070249844-A1 Pyrazole derivatives and process for the production thereof CBR3, CYP4Z1, CYP4F3 IDO1 232/4885MEN1 4541/4885KMT2A 4132/4885
US-20260022113-A1 Process for the Preparation of Pyroxasulfone AGXT, SLC6A5, CA2 IDO1 1504/4885MEN1 4292/4885KMT2A 2723/4885
US-20100285958-A1 Chiral 2-(benzylsulfinyl)Thiazole derivatives and 2-[(1H-pyrazol-4-ylmethyl)sulfinyl]thiazole derivatives, processes for their preparation and their use as herbicides and plant growth regulators STS, SULT2A1, SLTM IDO1 1220/4885MEN1 4644/4885KMT2A 2053/4885
US-20070015805-A1 Process for preparing 3-arylmethylthio- and 3-heteroarylmethylthio-4,5-dihydroisoxazoline derivatives CYP3A7, KMO, CYP4X1 IDO1 24/4885MEN1 1533/4885KMT2A 419/4885
US-20050215797-A1 Pyrazole derivatives and process for the production thereof CBR3, CYP4Z1, CYP4F3 IDO1 232/4885MEN1 4541/4885KMT2A 4132/4885

“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.