Bromomethane

Bromomethane

SCHEMBL7085461

CBr.O=C(OCC(=CO)c1ccccc1)C(O)(c1ccc(F)c(Cl)c1)c1ccc(F)c(Cl)c1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
GRIN1 Q05586 1/20 0.34
GRIN2A Q12879 1/20 0.34
GRIN2B Q13224 1/20 0.34
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
CHRM2 P08172 2/20 0.33
CHRM1 P11229 2/20 0.33
CHRM3 P20309 2/20 0.33
PDPK1 O15530 2/20 0.33
POLB P06746 1/20 0.33
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CHRM4 P08173 1/20 0.32
NR1H2 P55055 1/20 0.32
NR1H3 Q13133 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2C19 P33261 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
SCHEMBL7085713 0.97 NPC1 (0.41) NPC1RAB9AGRIN1GRIN2AGRIN2B
Bromomethane SCHEMBL7086475 0.92 PPARG (0.34) NPC1RAB9AMEN1KMT2ACHRM2
Bromomethane SCHEMBL119398 0.90 KCNN4 (0.38) NPC1RAB9AMEN1KMT2ACHRM2
Bromomethane SCHEMBL7084864 0.90 PDPK1 (0.39) NPC1RAB9AMEN1KMT2ACHRM2
SCHEMBL7086476 0.88 PPARG (0.36) NPC1RAB9AMEN1KMT2ACHRM2
Bromomethane SCHEMBL7081929 0.87 KMT2A (0.44) MEN1KMT2ACHRM2CHRM1CHRM3
SCHEMBL7082177 0.87 PDPK1 (0.41) NPC1RAB9AMEN1KMT2ACHRM2
SCHEMBL543310 0.87 KCNN4 (0.40) NPC1RAB9AMEN1KMT2ACHRM2
Bromomethane SCHEMBL7087263 0.86 SCN5A (0.37) MEN1KMT2ACHRM2CHRM1CHRM3
Bromomethane SCHEMBL118164 0.84 CHRM2 (0.39) NPC1RAB9AMEN1KMT2ACHRM2

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