Bromide

Bromide

SCHEMBL1194586

O=C(C[n+]1cccc(-c2cc(C(c3ccccc3)c3ccccc3)n[nH]2)c1)c1cc([N+](=O)[O-])cs1.[Br-]

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHECHKACHRM1CHRM2CHRM3CHRM4CHRM5CHRNA1CHRNB1CHRNDCHRNECHRNGHRH2OPRM1

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
ALDH1A1 P00352 5/20 0.38
MAPT P10636 4/20 0.38
KMT2A Q03164 5/20 0.37
MEN1 O00255 4/20 0.37
LMNA P02545 4/20 0.34
HTT P42858 2/20 0.34
RAB9A P51151 2/20 0.34
GAA P10253 1/20 0.34
LTA4H P09960 1/20 0.33
PLA2G2A P14555 1/20 0.33
POLB P06746 3/20 0.32
KDM4E B2RXH2 2/20 0.32
HPGD P15428 1/20 0.31
PABPC1 P11940 1/20 0.30
ATM Q13315 1/20 0.30
AHR P35869 1/20 0.30
CASP6 P55212 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
MIF P14174 1/20 0.30

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
SCHEMBL6618821 0.99 MAPT (0.36) ALDH1A1MAPTKMT2AMEN1LMNA
Bromide SCHEMBL6597813 0.90 MAPT (0.34) ALDH1A1MAPTKMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL6611866 0.82 POLB (0.38) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL6598021 0.81 KMT2A (0.45) ALDH1A1MAPTKMT2AMEN1LMNA
Hydrochloric Acid SCHEMBL1193657 0.80 KMT2A (0.44) ALDH1A1MAPTKMT2AMEN1LMNA
Bromide SCHEMBL6598138 0.78 MAPT (0.32) ALDH1A1MAPTKMT2AMEN1POLB
Bromide SCHEMBL1194391 0.78 SMN1; SMN2 (0.38) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL6597394 0.77 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL3689760 0.77 SMN1; SMN2 (0.39) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL6598296 0.75 SMN1; SMN2 (0.38) ALDH1A1MAPTKMT2AMEN1LMNA

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-20110034378-A1 Pharmaceutical Combinations Comprising Specified Age Breaker and Further Drugs, I.A. Antihypertensive Drugs, Antidiabetic Drugs Etc. TORRENT PHARMACEUTICALS LTD. (IN) 2011-02-10 US claimed
US-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2007-07-19 US claimed
US-7223777-B2 Compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. (IN) 2007-05-29 US claimed
EP-1373263-B1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS TORRENT PHARMACEUTICALS LTD (IN) 2004-10-27 EP claimed
WO-2002085897-A9 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2004-04-01 WO claimed
EP-1373263-A1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS Torrent Pharmaceuticals Ltd (IN) 2004-01-02 EP claimed
US-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2003-03-06 US claimed
WO-2002085897-A1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2002-10-31 WO claimed
US-20110034378-A1 Pharmaceutical Combinations Comprising Specified Age Breaker and Further Drugs, I.A. Antihypertensive Drugs, Antidiabetic Drugs Etc. TORRENT PHARMACEUTICALS LTD. (IN) 2011-02-10 US disclosed
US-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2007-07-19 US disclosed
US-7223777-B2 Compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. (IN) 2007-05-29 US disclosed
EP-1373263-B1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS TORRENT PHARMACEUTICALS LTD (IN) 2004-10-27 EP disclosed
WO-2002085897-A9 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2004-04-01 WO disclosed
EP-1373263-A1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS Torrent Pharmaceuticals Ltd (IN) 2004-01-02 EP disclosed
US-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2003-03-06 US disclosed
WO-2002085897-A1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2002-10-31 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 (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-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof AGER, GLA, F12 ALDH1A1 132/4885MAPT 4105/4885KMT2A 3588/4885
US-20110034378-A1 Pharmaceutical Combinations Comprising Specified Age Breaker and Further Drugs, I.A. Antihypertensive Drugs, Antidiabetic Drugs Etc. AGER, F12, DPP4 ALDH1A1 528/4885MAPT 4535/4885KMT2A 3384/4885
US-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof AGER, GLA, F12 ALDH1A1 226/4885MAPT 4043/4885KMT2A 3499/4885

“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.