SCHEMBL733054

SCHEMBL733054

Cc1cc(=O)oc2cc(B3OCC(C)(C)CO3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.49
KDM4E B2RXH2 9/20 0.49
HPGD P15428 7/20 0.49
HSD17B10 Q99714 7/20 0.49
CA9 Q16790 7/20 0.49
CA12 O43570 6/20 0.49
GAA P10253 5/20 0.49
GLA P06280 4/20 0.49
CA1 P00915 4/20 0.49
CASP1 P29466 3/20 0.49
CASP7 P55210 3/20 0.49
LMNA P02545 2/20 0.49
AKR1B1 P15121 2/20 0.49
MCL1 Q07820 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C9 P11712 1/20 0.49
UGT1A1 P22309 1/20 0.49
MAOB P27338 1/20 0.49
KDR P35968 1/20 0.49
HSD17B3 P37058 1/20 0.49

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
SCHEMBL734384 0.82 CSF1R (0.53) ALDH1A1KDM4EHPGDHSD17B10CA9
SCHEMBL13406788 0.75 ALDH1A1 (0.46) ALDH1A1KDM4EHPGDHSD17B10CA9
SCHEMBL16626289 0.73 SNCA (0.39) ALDH1A1TSHR
SCHEMBL4264297 0.70 SNCA (0.44) CA9CA12CA1CA2CA5A
SCHEMBL19194216 0.70 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDHSD17B10CA9
SCHEMBL22347976 0.69 SNCA (0.43) ALDH1A1KDM4EHSD17B10GAACYP1A2
SCHEMBL724134 0.69 ALDH1A1 (0.68) ALDH1A1KDM4EHPGDHSD17B10CA9
SCHEMBL12524584 0.69 SNCA (0.46)
SCHEMBL14680552 0.69 SNCA (0.44)
Hydrochloric Acid SCHEMBL30117164 0.68 ALDH1A1 (0.66) ALDH1A1KDM4EHPGDHSD17B10CA9

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