Bromide

Bromide

SCHEMBL2778445

Br.c1ccc(-c2cccc3c2Nc2ccccc2O3)cc1

nearest known ligand 0.55

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
ALOX5 P09917 8/20 0.55
MAPT P10636 5/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
BRD4 O60885 1/20 0.38
CREBBP Q92793 1/20 0.38
MEN1 O00255 3/20 0.37
KMT2A Q03164 3/20 0.37
GAA P10253 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 1/20 0.36
DHODH Q02127 1/20 0.36
POLB P06746 2/20 0.35
ALDH1A1 P00352 1/20 0.35
TP53 P04637 2/20 0.35
KDM4E B2RXH2 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34
PLK4 O00444 1/20 0.34
MAPK9 P45984 1/20 0.34

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
SCHEMBL2774415 0.98 ALOX5 (0.57) ALOX5MAPTL3MBTL1TDP1BRD4
Thiophene SCHEMBL27871601 0.89 ALOX5 (0.49) ALOX5MAPTL3MBTL1TDP1BRD4
SCHEMBL29177922 0.87 ALOX5 (0.50) ALOX5MAPTL3MBTL1TDP1BRD4
SCHEMBL9093133 0.87 ALOX5 (0.50) ALOX5MAPTL3MBTL1TDP1BRD4
SCHEMBL30208696 0.85 ALOX5 (0.48) ALOX5MAPTL3MBTL1TDP1MEN1
SCHEMBL21523872 0.85 ALOX5 (0.48) ALOX5MAPTL3MBTL1TDP1MEN1
SCHEMBL22581204 0.85 ALOX5 (0.48) ALOX5MAPTL3MBTL1TDP1MEN1
SCHEMBL4074613 0.85 ALOX5 (0.48) ALOX5MAPTL3MBTL1TDP1MEN1
SCHEMBL18834556 0.84 ALOX5 (0.47) ALOX5MAPTL3MBTL1TDP1BRD4
SCHEMBL3810808 0.84 ALOX5 (0.47) ALOX5MAPTL3MBTL1TDP1BRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7794858-B2 Phenylphenoxazine or phenylphenothiazine- based compound and organic electroluminescent device using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-09-14 US claimed
US-20090026928-A1 PHENYLPHENOXAZINE OR PHENYLPHENOTHIAZINE- BASED COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-01-29 US claimed
US-7794858-B2 Phenylphenoxazine or phenylphenothiazine- based compound and organic electroluminescent device using the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2010-09-14 US disclosed
US-20090026928-A1 PHENYLPHENOXAZINE OR PHENYLPHENOTHIAZINE- BASED COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2009-01-29 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 (1 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-20090026928-A1 PHENYLPHENOXAZINE OR PHENYLPHENOTHIAZINE- BASED COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME TYR, MITF, PPOX ALOX5 400/4885MAPT 353/4885L3MBTL1 2826/4885

“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.