Bromide

Bromide

SCHEMBL813674

Cc1cccc(C)c1NC(C)CNCC(C)Nc1c(C)cccc1C.[Br-].[Br-].[Co+2]

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
ALOX12 P18054 1/20 0.38
RECQL P46063 1/20 0.38
LMNA P02545 6/20 0.33
BLM P54132 2/20 0.33
ANPEP P15144 1/20 0.33
CYP1A2 P05177 3/20 0.33
CYP2C9 P11712 3/20 0.33
NFKB1 P19838 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP2C19 P33261 1/20 0.33
SGMS2 Q8NHU3 1/20 0.32
MAPK1 P28482 2/20 0.32
ATM Q13315 1/20 0.32
SCN4A P35499 4/20 0.32
SCN3A Q9NY46 3/20 0.32
SCN1A P35498 3/20 0.32
SCN5A Q14524 3/20 0.32
SCN9A Q15858 3/20 0.32
CYP3A4 P08684 3/20 0.32

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
Hydrochloric Acid SCHEMBL812282 0.96 ALOX12 (0.38) ALOX12RECQLLMNAANPEPCYP1A2
SCHEMBL10391937 0.87 LMNA (0.40) ALOX12RECQLLMNABLMANPEP
Hydrochloric Acid SCHEMBL10392365 0.85 LMNA (0.39) ALOX12RECQLLMNABLMANPEP
SCHEMBL11176677 0.82 ALOX12 (0.36) ALOX12RECQLLMNABLMANPEP
Bromide SCHEMBL813004 0.81 RAPGEF4 (0.41) LMNACYP1A2CYP2C9CYP2C19CYP3A4
Hydrochloric Acid SCHEMBL11170663 0.81 ALOX12 (0.35) ALOX12RECQLLMNABLMANPEP
Bromide SCHEMBL813987 0.79 MEN1 (0.36) ALOX12RECQLLMNABLMANPEP
Bromide SCHEMBL813654 0.79 SMN1; SMN2 (0.41) LMNABLMCYP1A2MEN1KMT2A
Bromide SCHEMBL813723 0.78 HTT (0.38) ANPEPCYP2C19SCN5ATSHRKCNH2
SCHEMBL13091238 0.78 ALDH1A1 (0.52) ALOX12RECQLLMNABLMANPEP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8058372-B2 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. (US) 2011-11-15 US disclosed
US-20080319147-A1 Catalyst Composition II EXXONMOBIL CHEMICAL PATENTS INC. 2008-12-25 US disclosed
US-7371803-B2 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-05-13 US disclosed
US-20070066776-A1 Catalyst composition II SOLAN GREGORY A 2007-03-22 US disclosed
US-7189791-B2 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-03-13 US disclosed
US-20040266961-A1 Catalyst composition II EXXONMOBIL CHEMICAL PATENTS INC. 2004-12-30 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-20040266961-A1 Catalyst composition II MLX, CBX2, BMX ALOX12 586/4885RECQL 3146/4885LMNA 25/4885

“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.