Bromide

Bromide

SCHEMBL813689

Cc1cc(C)c(NC(C)CN(Cc2ccccn2)CC(C)Nc2c(C)cc(C)cc2C)c(C)c1.[Br-].[Br-].[Co+2]

nearest known ligand 0.44

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
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
LIN28A Q9H9Z2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
CYP2C19 P33261 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
APP P05067 1/20 0.37
GLA P06280 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KMT2A Q03164 3/20 0.36
MEN1 O00255 1/20 0.36
DUSP3 P51452 1/20 0.36
PTPN11 Q06124 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
RECQL P46063 1/20 0.36
LMNA P02545 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35

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 SCHEMBL813125 0.99 MAPT (0.45) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Bromide SCHEMBL820668 0.90 MAPT (0.46) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Bromide SCHEMBL812904 0.89 MAPT (0.41) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Hydrochloric Acid SCHEMBL813874 0.88 SMN1; SMN2 (0.47) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Hydrochloric Acid SCHEMBL812442 0.88 MAPT (0.42) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Bromide SCHEMBL812947 0.82 MAPT (0.44) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Bromide SCHEMBL813732 0.82 SMN1; SMN2 (0.41) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Bromide SCHEMBL815490 0.81 MAPT (0.43) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Bromide SCHEMBL813588 0.81 TDP1 (0.40) MAPTSMN1; SMN2LIN28ATDP1CYP2C19
Hydrochloric Acid SCHEMBL813563 0.81 MAPT (0.45) MAPTSMN1; SMN2LIN28ATDP1CYP2C19

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 MAPT 1902/4885SMN1; SMN2 1110/4885LIN28A 344/4885

“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.