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Sugi Predict / Compounds / Bromomethane

Bromomethane

Bromomethane

SCHEMBL931692

CBr.O=C(OCC(=CO)c1ccccc1)C(O)(c1ccccc1)c1cccc(F)c1F

nearest known ligand 0.35

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CHRM2 P08172 4/20 0.35
▸ CHRM1 P11229 4/20 0.35
▸ CHRM3 P20309 4/20 0.35
▸ POLB P06746 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CHRM4 P08173 2/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ KCNN4 O15554 3/20 0.32
▸ CHRM5 P08912 1/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.31
▸ PDPK1 O15530 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ KCNE1 P15382 1/20 0.30
▸ KCNQ1 P51787 1/20 0.30

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
SCHEMBL6244686 0.97 CHRM3 (0.34) CHRM2CHRM1CHRM3POLBMEN1
Bromomethane SCHEMBL7085436 0.95 PDPK1 (0.32) CHRM2CHRM1CHRM3POLBMEN1
SCHEMBL7086017 0.91 POLB (0.33) POLBMEN1KMT2AALDH1A1KCNN4
Bromomethane SCHEMBL118164 0.82 CHRM2 (0.39) CHRM2CHRM1CHRM3POLBMEN1
Bromomethane SCHEMBL120034 0.81 KCNN4 (0.39) CHRM2CHRM1CHRM3POLBMEN1
Bromomethane SCHEMBL14142455 0.79 LMNA (0.42) CHRM3POLBMEN1KMT2AALDH1A1
Bromomethane SCHEMBL119398 0.79 KCNN4 (0.38) CHRM2CHRM1CHRM3POLBMEN1
Bromomethane SCHEMBL7081897 0.79 CHRM2 (0.36) CHRM2CHRM1CHRM3POLBMEN1
SCHEMBL14142466 0.78 CHRM3 (0.34) CHRM2CHRM1CHRM3POLBMEN1
Bromomethane SCHEMBL7086772 0.78 NPC1 (0.41) CHRM2CHRM1CHRM3POLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2654657-A1 PACKAGINGS WITH ADSORBENT FOR MEDICINAL PRODUCTS Boehringer Ingelheim International GmbH (DE) 2013-10-30 — — EP disclosed
WO-2012084017-A1 PACKAGINGS WITH ADSORBENT FOR MEDICINAL PRODUCTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-28 — — WO disclosed
EP-2373366-A1 INHALER Boehringer Ingelheim International GmbH (DE) 2011-10-12 — — EP disclosed
WO-2011000669-A1 PACKAGES WITH ADSORBENT FOR MEDICINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-01-06 — — WO disclosed
EP-2247581-A2 CRISTALLINES, ENANTIOMERICALLY PURE SALT FORM OF A BETAMIMETIC AGENT, AND THE USE THEREOF AS A MEDICAMENT Boehringer Ingelheim International GmbH (DE) 2010-11-10 — — EP disclosed
WO-2010063645-A1 INHALER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-06-10 — — WO disclosed
WO-2009103479-A2 CRISTALLINES, ENANTIOMERICALLY PURE SALT FORM OF A BETAMIMETIC AGENT, AND THE USE THEREOF AS A MEDICAMENT BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-08-27 — — WO disclosed
EP-2007457-A1 INHALER Boehringer Ingelheim International GmbH (DE) 2008-12-31 — — EP disclosed
EP-2004261-A1 MEDICAMENT DELIVERY DEVICE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-12-24 — — EP disclosed
EP-1981574-A1 ADAPTER FOR INHALATION APPLIANCES FOR TREATMENT OF ARTIFICIALLY VENTILATED PATIENTS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2008-10-22 — — EP disclosed
WO-2007118341-A1 MEDICAMENT DELIVERY DEVICE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-25 — — WO disclosed
WO-2007118801-A1 INHALER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-25 — — WO disclosed
WO-2007088188-A1 ADAPTER FOR INHALATION APPLIANCES FOR TREATMENT OF ARTIFICIALLY VENTILATED PATIENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2007-08-09 — — WO disclosed