SCHEMBL533173

SCHEMBL533173

COC(=O)Cc1cc(=O)oc2cc(O)ccc12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 1.00
KDM4E B2RXH2 7/20 1.00
GLA P06280 4/20 1.00
GAA P10253 4/20 1.00
HPGD P15428 3/20 0.74
HSD17B3 P37058 10/20 0.70
LCK P06239 2/20 0.70
AKR1B1 P15121 2/20 0.70
FYN P06241 1/20 0.70
GRB2 P62993 1/20 0.70
ERAP1 Q9NZ08 1/20 0.59
CASP1 P29466 2/20 0.54
CASP7 P55210 2/20 0.54
HSD17B10 Q99714 2/20 0.54
CA12 O43570 1/20 0.54
LMNA P02545 1/20 0.54
CYP1A2 P05177 1/20 0.54
CYP2C9 P11712 1/20 0.54
UGT1A1 P22309 1/20 0.54
MAOB P27338 1/20 0.54

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
SCHEMBL23132281 0.87 ALDH1A1 (0.77) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL4209634 0.86 KDM4E (0.76) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL14564349 0.86 ALDH1A1 (0.76) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL7919714 0.85 KDM4E (0.74) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL7919717 0.85 KDM4E (0.74) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL13840541 0.84 AKR1B1 (0.76) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL14399202 0.83 ALDH1A1 (0.71) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL5433316 0.83 KDM4E (0.71) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL29115101 0.83 ALDH1A1 (0.70) ALDH1A1KDM4EGLAGAAHPGD
SCHEMBL263980 0.82 AKR1B1 (1.00) ALDH1A1KDM4EGLAGAAHSD17B3

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160003836-A1 PHOTO OR CHEMOLABILE CONJUGATES FOR MOLECULES DETECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-01-07 US disclosed
US-20160003836-A1 PHOTO OR CHEMOLABILE CONJUGATES FOR MOLECULES DETECTION CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2016-01-07 US disclosed
US-20150253245-A1 FLUORESCENT POLYMERS OF 7-HYDROXYCOUMARIN COMPOUNDS, CHEMICAL SENSORS COMPRISING THEM, AND POLYMERIZABLE FLUORESCENT COMPOUND OF 7-HYDROXYCOUMARIN Commissariat a l'énergie atomique et aux énergies alternatives (FR) 2015-09-10 US disclosed
US-8993700-B2 Fluorescent polymers of 7-hydroxycoumarin compounds, chemical sensors comprising them, and polymerizable fluorescent compound of 7-hydroxycoumarin COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2015-03-31 US disclosed
WO-2014125112-A1 PHOTO OR CHEMOLABILE CONJUGATES FOR MOLECULES DETECTION IMABIOTECH (FR) 2014-08-21 WO disclosed
EP-2767832-A1 Photo or chemolabile conjugates for molecules detection Imabiotech (FR) 2014-08-20 EP disclosed
EP-1430147-B1 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS EPOCH BIOSCIENCES INC (US) 2013-05-22 EP disclosed
US-20120178172-A1 FLUORESCENT POLYMERS OF 7-HYDROXYCOUMARIN COMPOUNDS, CHEMICAL SENSORS COMPRISING THEM, AND POLYMERIZABLE FLUORESCENT COMPOUND OF 7-HYDROXYCOUMARIN COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2012-07-12 US disclosed
EP-1235938-B1 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS EPOCH BIOSCIENCES INC (US) 2012-02-08 EP disclosed
US-7897736-B2 Fluorescent quenching detecting reagents and methods ELITECH HOLDING B.V. (NL) 2011-03-01 US disclosed
US-20030096254-A1 Enhancing resonance ability of oligonuclotide probes for use in hybridization assays; gene expression EPOCH BIOSCIENCES, INC. (US) 2003-05-22 US disclosed
US-20030008304-A1 Fluorescent quenching detection reagents and methods EPOCH BIOSCIENCES, INC. (US) 2003-01-09 US disclosed
WO-2002099141-A1 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS EPOCH BIOSCIENCES, INC. (US) 2002-12-12 WO disclosed
US-20020155484-A1 Fluorescent quenching detection reagents and methods EPOCH PHARMACEUTICALS, INC. (US) 2002-10-24 US disclosed
EP-1235938-A2 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS Epoch Biosciences, Inc. (US) 2002-09-04 EP disclosed
US-20020034754-A1 Fluorescent quenching detection reagents and methods ELITECHGROUP, INC. 2002-03-21 US disclosed
WO-2001042505-A2 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS EPOCH BIOSCIENCES, INC. (US) 2001-06-14 WO disclosed
EP-1062361-A2 WATER-SOLUBLE COUMARIN FLUORESCENT ENZYME SUBSTRATES ABBOTT LABORATORIES (US) 2000-12-27 EP disclosed
US-5998593-A COUMARIN DERIVATIVES ABBOTT LABORATORIES (US) 1999-12-07 US disclosed
WO-1999046402-A2 WATER-SOLUBLE COUMARIN FLUORESCENT ENZYME SUBSTRATES ABBOTT LABORATORIES (US) 1999-09-16 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030008304-A1 Fluorescent quenching detection reagents and methods DDX5, DDX21, DCLRE1B ALDH1A1 2350/4885KDM4E 4634/4885GLA 1490/4885
US-20020034754-A1 Fluorescent quenching detection reagents and methods DDX5, DDX21, DCLRE1B ALDH1A1 2350/4885KDM4E 4634/4885GLA 1490/4885
US-20020155484-A1 Fluorescent quenching detection reagents and methods IPO4, PTBP3, DDX5 ALDH1A1 3183/4885KDM4E 3864/4885GLA 4633/4885
US-20030096254-A1 Enhancing resonance ability of oligonuclotide probes for use in hybridization assays; gene expression DCLRE1B, SNRPE, ZFR ALDH1A1 2641/4885KDM4E 4757/4885GLA 1950/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.