Bromide

Bromide

SCHEMBL813987

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

nearest known ligand 0.36

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
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
HTR1D P28221 1/20 0.34
ADRA2A P08913 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
ALOX12 P18054 1/20 0.34
RECQL P46063 1/20 0.34
LMNA P02545 4/20 0.33
MAPT P10636 3/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
MC4R P32245 1/20 0.33
SCN4A P35499 1/20 0.33
MC3R P41968 1/20 0.33
HTR3A P46098 1/20 0.33
SCN5A Q14524 1/20 0.33
SCN9A Q15858 1/20 0.33
SCN3A Q9NY46 1/20 0.33

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 SCHEMBL815765 0.96 HTR1D (0.38) MEN1KMT2AHTR1DADRA2AADRA2B
SCHEMBL10390601 0.81 MAPT (0.47) HTR1DALOX12RECQLLMNAMAPT
SCHEMBL10391693 0.81 HTR1D (0.34) MEN1KMT2AHTR1DADRA2AADRA2B
Bromide SCHEMBL813699 0.81 RAPGEF4 (0.40) LMNAALDH1A1CYP3A4CYP1A2CYP2C9
Bromide SCHEMBL813163 0.80 SMN1; SMN2 (0.44) MEN1KMT2ALMNACYP3A4BLM
SCHEMBL10391114 0.80 ALOX12 (0.34) MEN1KMT2AHTR1DADRA2AADRA2B
Bromide SCHEMBL813674 0.79 ALOX12 (0.38) MEN1KMT2AALOX12RECQLLMNA
Bromide SCHEMBL813697 0.79 HTT (0.37) MEN1KMT2AADRA2AADRA2BADRA2C
Hydrochloric Acid SCHEMBL813745 0.78 RAPGEF4 (0.40) KMT2AHTR1DLMNAALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL813149 0.76 SMN1; SMN2 (0.44) MEN1KMT2ALMNACYP3A4BLM

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 MEN1 1095/4885KMT2A 530/4885HTR1D 4421/4885

“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.