SCHEMBL733052

SCHEMBL733052

COC(=C1C2CC3CC(C2)CC1C3)c1cccc(B(O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 7/20 0.41
EPHX2 P34913 3/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ESR1 P03372 1/20 0.33
MEN1 O00255 1/20 0.33
FAAH O00519 1/20 0.33
CNR2 P34972 1/20 0.33
KMT2A Q03164 1/20 0.33
MGLL Q99685 2/20 0.33
NLRP3 Q96P20 1/20 0.32
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
LPL P06858 1/20 0.31
LIPG Q9Y5X9 1/20 0.31
KDR P35968 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
Lithium Ion SCHEMBL9838485 0.82 EPHX2 (0.34) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL8445464 0.82 EPHX2 (0.34) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL25519094 0.81 RAB9A (0.40) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL8058782 0.81 FAAH (0.43) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL734321 0.81 FAAH (0.43) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL732169 0.80 ALDH1A1 (0.41) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL31236475 0.80 MEN1 (0.51) EPHX2ALDH1A1NPSR1MEN1FAAH
SCHEMBL7598259 0.80 MEN1 (0.51) EPHX2ALDH1A1NPSR1MEN1FAAH
SCHEMBL15435483 0.80 EPHX2 (0.34) EPHX2ALDH1A1MAPTHPGDNPSR1
SCHEMBL7599431 0.75 EPHX2 (0.48) EPHX2ALDH1A1MAPTMEN1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8137990-B2 Compositions for chemiluminescent detection of hydrogen peroxide LUMIGEN, INC. (US) 2012-03-20 US disclosed
US-8137990-B2 Compositions for chemiluminescent detection of hydrogen peroxide LUMIGEN, INC. (US) 2012-03-20 US disclosed
US-7704752-B2 Signalling compounds for use in methods of detecting hydrogen peroxide LUMIGEN, INC. (US) 2010-04-27 US disclosed
US-7704752-B2 Signalling compounds for use in methods of detecting hydrogen peroxide LUMIGEN, INC. (US) 2010-04-27 US disclosed
US-20100055800-A1 Compositions for Chemiluminescent Detection of Hydrogen Peroxide LUMIGEN, INC. (US) 2010-03-04 US disclosed
US-20100055800-A1 Compositions for Chemiluminescent Detection of Hydrogen Peroxide LUMIGEN, INC. (US) 2010-03-04 US disclosed
US-20080261318-A1 Signalling Compounds For Use In Methods Of Detecting Hydrogen Peroxide LUMIGEN, INC. (US) 2008-10-23 US disclosed
US-20080261318-A1 Signalling Compounds For Use In Methods Of Detecting Hydrogen Peroxide LUMIGEN, INC. (US) 2008-10-23 US disclosed
US-7390670-B2 Signalling compounds and methods for detecting hydrogen peroxide LUMIGEN, INC. (US) 2008-06-24 US disclosed
US-7390670-B2 Signalling compounds and methods for detecting hydrogen peroxide LUMIGEN, INC. (US) 2008-06-24 US disclosed