SCHEMBL2224693

SCHEMBL2224693

O=c1oc2cc(OP(=O)(O)O)ccc2cc1-c1cccs1

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAOB P27338 6/20 0.70
TMIGD3 P0DMS9 4/20 0.51
ADORA2A P29274 3/20 0.51
ADORA1 P30542 2/20 0.51
MAOA P21397 2/20 0.51
GPR35 Q9HC97 1/20 0.47
MAPT P10636 3/20 0.45
KDM4E B2RXH2 2/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
STS P08842 1/20 0.44
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
NR3C1 P04150 1/20 0.43
PGR P06401 1/20 0.43
AR P10275 1/20 0.43
GLA P06280 1/20 0.43

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
SCHEMBL4818435 0.83 MAOB (1.00) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL12967841 0.81 MAOB (0.74) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL381683 0.80 NPC1 (0.67) MAOBKDM4EMEN1KMT2APOLB
SCHEMBL24176811 0.80 MAOB (0.76) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL2224969 0.78 MAOB (0.69) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL7585916 0.78 MAOB (0.69) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL24240003 0.76 MAOB (0.69) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL6931761 0.76 MAOB (0.69) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL30349901 0.76 MAOB (0.69) MAOBTMIGD3ADORA2AADORA1MAOA
SCHEMBL23747968 0.76 MAOB (0.69) MAOBTMIGD3ADORA2AADORA1MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2516666-B1 METHODS OF DETECTING MICROORGANISMS AND KITS THEREFORE 3M INNOVATIVE PROPERTIES CO (US) 2016-04-20 EP disclosed
US-8802429-B2 System for detecting microorganisms 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-08-12 US disclosed
US-20130316443-A1 SYSTEM FOR DETECTING MICROORGANISMS 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-11-28 US disclosed
US-8518664-B2 Methods of determining the amount of microorganisms present in a test sample 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-08-27 US disclosed
EP-2516666-A1 METHODS OF DETECTING MICROORGANISMS AND KITS THEREFORE 3M Innovative Properties Company (US) 2012-10-31 EP disclosed
US-20120252049-A1 METHODS OF DETECTING MICROORGANISMS AND KITS THEREFORE 3M INNOVATIVE PROPERTIES COMPANY 2012-10-04 US disclosed
WO-2011087711-A1 METHODS OF DETECTING MICROORGANISMS AND KITS THEREFORE 3M INNOVATIVE PROPERTIES COMPANY (US) 2011-07-21 WO disclosed