SCHEMBL35792

SCHEMBL35792

COc1ccc(C(O)(c2ccc(OC)cc2OC)c2c(OC)cc(OC)cc2OC)c(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA7 P43166 1/20 0.48
CA9 Q16790 1/20 0.48
CA14 Q9ULX7 1/20 0.48
ALDH1A1 P00352 9/20 0.43
CYP1A2 P05177 7/20 0.43
CYP1A1 P04798 6/20 0.43
CYP1B1 Q16678 6/20 0.43
CYP3A4 P08684 4/20 0.43
MAPT P10636 4/20 0.42
HPGD P15428 3/20 0.42
RAD52 P43351 1/20 0.42
CYP2C19 P33261 3/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
CYP2E1 P05181 2/20 0.40
CYP2C8 P10632 2/20 0.40
CYP2D6 P10635 2/20 0.40

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
SCHEMBL35743 0.89 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL29539579 0.89 CA12 (0.56) CA12CA1CA2CA7CA9
SCHEMBL3724676 0.82 CA12 (0.48) CA12CA1CA2CA7CA9
SCHEMBL31018275 0.81 CYP1A2 (0.47) CA12CA1CA2CA7CA9
SCHEMBL31018274 0.81 CYP1A2 (0.47) CA12CA1CA2CA7CA9
SCHEMBL13226839 0.81 CA12 (0.47) CA12CA1CA2CA7CA9
SCHEMBL2214188 0.81 CYP1A2 (0.47) CA12CA1CA2CA7CA9
SCHEMBL30057750 0.81 CYP1A2 (0.47) CA12CA1CA2CA7CA9
SCHEMBL8784265 0.80 CA12 (0.50) CA12CA1CA2CA7CA9
SCHEMBL9115762 0.79 CA12 (0.54) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9115066-B2 Trisubstituted methyl alcohols and their polymerizable derivatives INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2015-08-25 US disclosed
US-20130202531-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2013-08-08 US disclosed
US-20130202531-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2013-08-08 US disclosed
US-20130197262-A1 TRISUBSTITUTED METHYL ALCOHOLS AND THEIR POLYMERIZABLE DERIVATIVES INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2013-08-01 US disclosed
US-8425996-B2 Indicators for detecting the presence of metabolic byproducts from microorganisms INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2013-04-23 US disclosed
US-8425996-B2 Indicators for detecting the presence of metabolic byproducts from microorganisms INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2013-04-23 US disclosed
US-8425996-B2 Indicators for detecting the presence of metabolic byproducts from microorganisms INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2013-04-23 US disclosed
US-20110274593-A1 PROCESSES FOR PREPARING A POLYMERIC INDICATOR FILM INDICATOR SYSTEMS INTERNATIONAL, INC. 2011-11-10 US disclosed
US-20110274593-A1 PROCESSES FOR PREPARING A POLYMERIC INDICATOR FILM INDICATOR SYSTEMS INTERNATIONAL, INC. 2011-11-10 US disclosed
EP-2382080-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS Indicator Systems International, Inc. (US) 2011-11-02 EP disclosed
US-20100196636-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2010-08-05 US disclosed
US-20100196636-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2010-08-05 US disclosed
US-20100196636-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. 2010-08-05 US disclosed
WO-2010085755-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS INDICATOR SYSTEMS INTERNATIONAL, INC. (US) 2010-07-29 WO disclosed
EP-0703498-B1 Photosensitive resin composition and method for forming a photoresist pattern MITSUBISHI CHEM CORP (JP) 1997-12-29 EP disclosed
US-5698362-A CONTAINING A TRIARYLMETHANE DERIVATIVE; HIGH RESOLUTION, EXCELLENT IN DEPTH OF FOCUS AND PATTERN PROFILE, STORAGE STABLE MITSUBISHI CHEMICAL CORPORATION (JP) 1997-12-16 US disclosed
EP-0703498-A1 Photosensitive resin composition and method for forming a photoresist pattern MITSUBISHI CHEMICAL CORPORATION (JP) 1996-03-27 EP 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 (2 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-20100196636-A1 INDICATORS FOR DETECTING THE PRESENCE OF METABOLIC BYPRODUCTS FROM MICROORGANISMS PGLS, MGAM, G6PD CA12 478/4885CA1 1450/4885CA2 1433/4885
US-20130197262-A1 TRISUBSTITUTED METHYL ALCOHOLS AND THEIR POLYMERIZABLE DERIVATIVES ADH1A, ADH5, ADH1C CA12 1052/4885CA1 3296/4885CA2 4248/4885

“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.