Bromomethane

Bromomethane

SCHEMBL7081897

CBr.O=C(OCC(=CO)c1ccccc1)C(O)(c1cc(F)cc(F)c1)c1cc(F)cc(F)c1

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 5/20 0.36
CHRM1 P11229 5/20 0.36
CHRM3 P20309 5/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
POLB P06746 2/20 0.36
CHRM4 P08173 2/20 0.35
ALDH1A1 P00352 2/20 0.34
PDPK1 O15530 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
VNN1 O95497 1/20 0.33
CHRM5 P08912 1/20 0.32
CYP2D6 P10635 1/20 0.32
KDM4E B2RXH2 1/20 0.32
SRC P12931 1/20 0.31
TRPA1 O75762 1/20 0.31
CYP1A2 P05177 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
PPARA Q07869 1/20 0.31

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
SCHEMBL7081056 0.96 MEN1 (0.36) CHRM2CHRM1CHRM3MEN1KMT2A
Bromomethane SCHEMBL120034 0.91 KCNN4 (0.39) CHRM2CHRM1CHRM3MEN1KMT2A
Bromomethane SCHEMBL118164 0.89 CHRM2 (0.39) CHRM2CHRM1CHRM3MEN1KMT2A
SCHEMBL3911903 0.87 KCNN4 (0.41) CHRM2CHRM1CHRM3MEN1KMT2A
Bromomethane SCHEMBL119398 0.86 KCNN4 (0.38) CHRM2CHRM1CHRM3MEN1KMT2A
SCHEMBL14142466 0.85 CHRM3 (0.34) CHRM2CHRM1CHRM3MEN1KMT2A
SCHEMBL931372 0.85 CHRM2 (0.39) CHRM2CHRM1CHRM3MEN1KMT2A
Bromomethane SCHEMBL14142455 0.84 LMNA (0.42) CHRM3MEN1KMT2APOLBALDH1A1
Bromomethane SCHEMBL7086475 0.83 PPARG (0.34) CHRM2CHRM1CHRM3MEN1KMT2A
Bromomethane SCHEMBL7085461 0.83 NPC1 (0.39) CHRM2CHRM1CHRM3MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328524-B1 NOVEL ANTICHOLINERGICS, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2012-12-12 EP disclosed
EP-1328524-A2 NOVEL ANTICHOLINERGICS, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2003-07-23 EP disclosed
WO-2002032898-A2 NOVEL ANTICHOLINERGICS, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-04-25 WO disclosed