SCHEMBL170709

SCHEMBL170709

CCc1ccc(Oc2cccc(C)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
TDP1 Q9NUW8 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
HTT P42858 2/20 0.54
ACHE P22303 1/20 0.48
FFAR1 O14842 1/20 0.48
HSD17B1 P14061 1/20 0.47
HSD17B2 P37059 1/20 0.47
AR P10275 2/20 0.46
GAA P10253 2/20 0.46
MMP14 P50281 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
GFER P55789 2/20 0.43
MAPK1 P28482 1/20 0.43
KDM4E B2RXH2 1/20 0.43
LYN P07948 1/20 0.43
MEN1 O00255 1/20 0.42
MITF O75030 1/20 0.42

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
SCHEMBL10013918 0.87 ALDH1A1 (0.65) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL14159532 0.87 ALDH1A1 (0.65) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL10013917 0.86 ALDH1A1 (0.80) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL14159539 0.86 ALDH1A1 (0.80) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL506995 0.85 ALDH1A1 (0.68) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL11736722 0.85 ALDH1A1 (0.53) ALDH1A1TDP1HTTFFAR1GAA
SCHEMBL260490 0.84 LTA4H (0.63) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL32670377 0.84 ALDH1A1 (0.61) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL6839352 0.84 ALDH1A1 (0.61) ALDH1A1TDP1L3MBTL1HTTACHE
SCHEMBL9502686 0.84 ALDH1A1 (0.61) ALDH1A1TDP1L3MBTL1HTTACHE

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-20140299864-A1 POLYMERS CONTAINING THERMALLY DISSOCIABLE AND SOLUBLE GROUPS AND THE USE OF SUCH POLYMERS AS ORGANIC ELECTROLUMINESCENT MATERIALS MITSUBISHI CHEMICAL CORPORATION (JP) 2014-10-09 US disclosed
US-20140299864-A1 POLYMERS CONTAINING THERMALLY DISSOCIABLE AND SOLUBLE GROUPS AND THE USE OF SUCH POLYMERS AS ORGANIC ELECTROLUMINESCENT MATERIALS MITSUBISHI CHEMICAL CORPORATION (JP) 2014-10-09 US disclosed
US-8795849-B2 Polymers containing thermally dissociable and soluble groups and the use of such polymers as organic electroluminescent materials MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-05 US disclosed
US-8795849-B2 Polymers containing thermally dissociable and soluble groups and the use of such polymers as organic electroluminescent materials MITSUBISHI CHEMICAL CORPORATION (JP) 2014-08-05 US disclosed
US-20120193617-A1 LOW-MOLECULAR COMPOUND, POLYMER, ELECTRONIC-DEVICE MATERIAL, COMPOSITION FOR ELECTRONIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC SOLAR CELL ELEMENT, DISPLAY AND LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2012-08-02 US disclosed
EP-1255738-B1 GONADOTROPIN-RELEASING HORMONE RECEPTOR ANTAGONISTS AND METHODS RELATING THERETO NEUROCRINE BIOSCIENCES INC (US) 2012-03-07 EP disclosed
US-20110192464-A1 POLYMER, LUMINESCENT-LAYER MATERIAL, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT, SOLAR CELL ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING EACH OBTAINED USING THESE MITSUBISHI CHEMICAL CORPORATION (JP) 2011-08-11 US disclosed
US-7932283-B2 Fungicide N-cyclopropyl-sulfonylamide derivatives BAYER CROPSCIENCE AG (DE) 2011-04-26 US disclosed
US-7880037-B2 Phosphonium supported triphenylphosphine; for controlling solubility of a molecule; oxidation of Cinnamyl Alcohol using above catalyst system VALORISATION-RECHERCHE, LIMITED PARTNERSHIP (CA) 2011-02-01 US disclosed
US-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives BAYER CROPSCIENCE AG (DE) 2009-05-28 US 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 (3 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-20120193617-A1 LOW-MOLECULAR COMPOUND, POLYMER, ELECTRONIC-DEVICE MATERIAL, COMPOSITION FOR ELECTRONIC DEVICE, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC SOLAR CELL ELEMENT, DISPLAY AND LIGHTING EPCAM, CDH1, THEM6 ALDH1A1 2277/4885TDP1 4312/4885L3MBTL1 1397/4885
US-20090137611-A1 Fungicide N-Cyclopropyl-Sulfonylamide Derivatives CYP51A1, ERG28, CBR3 ALDH1A1 2140/4885TDP1 2473/4885L3MBTL1 4555/4885
US-20110192464-A1 POLYMER, LUMINESCENT-LAYER MATERIAL, MATERIAL FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ORGANIC ELECTROLUMINESCENCE ELEMENT, SOLAR CELL ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING EACH OBTAINED USING THESE LEF1, EPCAM, EBPL ALDH1A1 2184/4885TDP1 2244/4885L3MBTL1 229/4885

“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.