Bromide

Bromide

SCHEMBL354286

Br.NC1CCc2ccc(O)cc2C1

nearest known ligand 0.96

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
ACHE known ✓ P22303 1/20 0.49
HTR1A known ✓ P08908 1/20 0.49
ADRB2 known ✓ P07550 1/20 0.49
DRD2 P14416 10/20 0.96
DRD3 P35462 10/20 0.96
OPRK1 P41145 1/20 0.83
MAPT P10636 3/20 0.65
KDM4E B2RXH2 1/20 0.65
NFKB1 P19838 1/20 0.61
THPO P40225 1/20 0.61
HIF1A Q16665 1/20 0.61
HSD17B10 Q99714 1/20 0.61
USP2 O75604 1/20 0.61
ALDH1A1 P00352 1/20 0.61
DRD4 P21917 6/20 0.56
PLAU P00749 1/20 0.55
LMNA P02545 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
CYP2D6 P10635 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
Bromide SCHEMBL354391 1.00 DRD2 (0.96) DRD2DRD3OPRK1MAPTKDM4E
Bromide SCHEMBL5722309 1.00 DRD2 (0.96) DRD2DRD3OPRK1MAPTKDM4E
SCHEMBL265949 0.98 DRD2 (1.00) DRD2DRD3OPRK1MAPTKDM4E
SCHEMBL30697493 0.98 DRD2 (1.00) DRD2DRD3OPRK1MAPTKDM4E
SCHEMBL9135070 0.98 DRD2 (1.00) DRD2DRD3OPRK1MAPTKDM4E
SCHEMBL5722322 0.98 DRD2 (1.00) DRD2DRD3OPRK1MAPTKDM4E
SCHEMBL30839518 0.98 DRD2 (1.00) DRD2DRD3OPRK1MAPTKDM4E
Hydrochloric Acid SCHEMBL9317222 0.96 DRD2 (0.96) DRD2DRD3OPRK1MAPTKDM4E
Water SCHEMBL9305270 0.96 DRD2 (0.96) DRD2DRD3OPRK1MAPTKDM4E
Water SCHEMBL9305264 0.96 DRD2 (0.96) DRD2DRD3OPRK1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 US disclosed
EP-0893432-B1 PHENYLETHANOLAMINOTETRALINCARBOXAMIDE DERIVATIVES KISSEI PHARMACEUTICAL (JP) 2006-11-08 EP disclosed
EP-0988296-B1 NAPHTHOTHIAZOLONE DERIVATIVES ACTIVE ON THE D 3 DOPAMINERGIC RECEPTOR ZAMBON SPA (IT) 2003-01-08 EP disclosed
EP-0882704-B1 3,4-DISUBSTITUTED PHENYLETHANOLAMINOTETRALINCARBOXAMIDE DERIVATIVES KISSEI PHARMACEUTICAL (JP) 2002-10-09 EP disclosed
US-6133266-A 3,4-disubstituted phenylethanolaminotetralincarboxamide derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 2000-10-17 US disclosed
US-6107318-A PSYCHOLOGICAL DISORDERS ZAMBON GROUP S.P.A. (IT) 2000-08-22 US disclosed
US-6046192-A Phenylethanolaminotetralincarboxamide derivatives KISSEI PHARMACEUTICAL CO., LTD. (JP) 2000-04-04 US disclosed
EP-0988296-A1 NAPHTHOTHIAZOLONE DERIVATIVES ACTIVE ON THE D 3 DOPAMINERGIC RECEPTOR ZAMBON GROUP S.p.A. (IT) 2000-03-29 EP disclosed
EP-0893432-A1 PHENYLETHANOLAMINOTETRALINCARBOXAMIDE DERIVATIVES Kissei Pharmaceutical Co. Ltd. (JP) 1999-01-27 EP disclosed
WO-1998056778-A1 NAPHTHOTHIAZOLONE DERIVATIVES ACTIVE ON THE D3 DOPAMINERGIC RECEPTOR ZAMBON GROUP S.P.A. (IT) 1998-12-17 WO disclosed
EP-0882704-A1 3,4-DISUBSTITUTED PHENYLETHANOLAMINOTETRALINCARBOXAMIDE DERIVATIVES KISSEI PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed
US-5312961-A 2-amino-7-hydroxytetralin carboxylalkyl ethers ELF SANOFI (FR) 1994-05-17 US disclosed
US-5254595-A Aryloxypropanolaminotetralins, a process for their preparation and pharmaceutical compositions containing them ELF SANOFI (FR) 1993-10-19 US disclosed
US-5235103-A Process for the preparation of phenylethanolaminotetralins SANOFI (FR) 1993-08-10 US disclosed
US-5202466-A 2-amino-7-hydroxytetraline ethers SANOFI (FR) 1993-04-13 US disclosed
US-5198586-A Process for the preparation of phenylethanolaminotetralins SANOFI (FR) 1993-03-30 US disclosed
US-5159103-A 2-amino-7-hydroxytetraline ethers SANOFI (FR) 1992-10-27 US 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-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 ACHE 3488/4885HTR1A 868/4885ADRB2 2363/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 ACHE 1462/4885HTR1A 382/4885ADRB2 1743/4885

“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.