Bromide

Bromide

SCHEMBL813369

CCc1cccc(CC)c1NCCN(C)CCNc1c(C)cccc1C.[Br-].[Br-].[Co+2]

nearest known ligand 0.42

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 18)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 1/20 0.37
ALDH1A1 P00352 3/20 0.42
HSD17B10 Q99714 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HTT P42858 2/20 0.41
ALOX12 P18054 1/20 0.41
RAB9A P51151 1/20 0.40
PTGS2 P35354 1/20 0.40
NLRP3 Q96P20 1/20 0.39
NPSR1 Q6W5P4 1/20 0.38
POLB P06746 1/20 0.38
OPRD1 P41143 1/20 0.37

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 SCHEMBL814052 0.97 ALDH1A1 (0.42) ALDH1A1HSD17B10KDM4EMAPTHPGD
Bromide SCHEMBL813304 0.92 KCNH2 (0.39) ALDH1A1HSD17B10KDM4EMAPTHPGD
Bromide SCHEMBL814475 0.90 GAA (0.39) ALDH1A1HSD17B10KDM4EMAPTHPGD
Hydrochloric Acid SCHEMBL813519 0.89 KCNH2 (0.39) ALDH1A1HSD17B10KDM4EMAPTHPGD
Bromide SCHEMBL814465 0.89 MAPT (0.36) ALDH1A1MAPTMEN1KMT2AHTT
Bromide SCHEMBL813702 0.89 ALDH1A1 (0.36) ALDH1A1HSD17B10KDM4EMAPTHPGD
SCHEMBL813698 0.87 KCNH2 (0.40) ALDH1A1HSD17B10KDM4EMAPTHPGD
SCHEMBL814896 0.87 KCNH2 (0.40) ALDH1A1HSD17B10KDM4EMAPTHPGD
SCHEMBL820606 0.87 KCNH2 (0.40) ALDH1A1HSD17B10KDM4EMAPTHPGD
SCHEMBL814729 0.87 KCNH2 (0.40) ALDH1A1HSD17B10KDM4EMAPTHPGD

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 OPRM1 551/4885ALDH1A1 4593/4885HSD17B10 3328/4885

“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.