Bromide

Bromide

SCHEMBL813004

Cc1cc(C)c(NC(C)CNCC(C)Nc2c(C)cc(C)cc2C)c(C)c1.[Br-].[Br-].[Co+2]

nearest known ligand 0.41

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 11)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 11/20 0.41
ALDH1A1 P00352 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
FFAR4 Q5NUL3 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.32
NR3C1 P04150 1/20 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 SCHEMBL813707 0.96 RAPGEF4 (0.41) RAPGEF4ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL11177259 0.82 RAPGEF4 (0.43) RAPGEF4ALDH1A1CYP1A2CYP3A4CYP2C9
Bromide SCHEMBL813238 0.81 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
Bromide SCHEMBL813674 0.81 ALOX12 (0.38) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL11183662 0.81 RAPGEF4 (0.41) RAPGEF4ALDH1A1CYP1A2CYP3A4CYP2C9
Bromide SCHEMBL813699 0.79 RAPGEF4 (0.40) RAPGEF4ALDH1A1CYP1A2CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL813554 0.78 ALDH1A1 (0.35) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL812282 0.77 ALOX12 (0.38) ALDH1A1CYP1A2CYP3A4CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL813745 0.76 RAPGEF4 (0.40) RAPGEF4ALDH1A1CYP1A2CYP3A4CYP2C9
SCHEMBL11171870 0.75 RAPGEF4 (0.41) RAPGEF4FFAR4GAANR3C1

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 RAPGEF4 4437/4885ALDH1A1 4593/4885CYP1A2 1139/4885

“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.