SCHEMBL5745446

SCHEMBL5745446

COc1ccc2ccc3[c]ccc4ccc1c2c34

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.36
MAPT P10636 4/20 0.34
HPGD P15428 3/20 0.32
ALDH1A1 P00352 3/20 0.32
HSD17B10 Q99714 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
USP2 O75604 2/20 0.32
HSP90AA1 P07900 1/20 0.32
HSP90AB1 P08238 1/20 0.32
ALOX15 P16050 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
KMT2A Q03164 3/20 0.31
KDM4E B2RXH2 3/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 2/20 0.31
PRMT1 Q99873 1/20 0.31

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
SCHEMBL5749897 1.00 NQO1 (0.36) NQO1MAPTHPGDALDH1A1HSD17B10
SCHEMBL5750455 0.83 PPARG (0.39) NQO1MAPTHPGDALDH1A1HSD17B10
SCHEMBL19999172 0.81 NQO1 (0.50) NQO1MAPTHPGDALDH1A1HSD17B10
SCHEMBL10392528 0.81 NQO1 (0.50) NQO1MAPTHPGDALDH1A1HSD17B10
SCHEMBL29876078 0.81 NQO1 (0.50) NQO1MAPTHPGDALDH1A1HSD17B10
SCHEMBL5750301 0.79 PPARG (0.40) NQO1MAPTHPGDALDH1A1HSD17B10
SCHEMBL5746196 0.78 ALDH1A1 (0.55) HPGDALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL5748360 0.78 ALDH1A1 (0.55) HPGDALDH1A1HSD17B10TDP1CYP3A4
SCHEMBL1046484 0.77 ALDH1A1 (0.33) HPGDALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL578387 0.77 ALDH1A1 (0.33) HPGDALDH1A1HSD17B10CYP3A4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9296738-B2 Organic electroluminescent material, the process for preparing the same and OLED device using the same EVERDISPLAY OPTRONICS (SHANGHAI) LIMITED (CN) 2016-03-29 US claimed
US-20150203485-A1 ORGANIC ELECTROLUMINESCENT MATERIAL, THE PROCESS FOR PREPARING THE SAME AND OLED DEVICE USING THE SAME EVERDISPLAY OPTRONICS (SHANGHAI) CO., LTD. (CN) 2015-07-23 US claimed
US-9296738-B2 Organic electroluminescent material, the process for preparing the same and OLED device using the same EVERDISPLAY OPTRONICS (SHANGHAI) LIMITED (CN) 2016-03-29 US disclosed
US-20150203485-A1 ORGANIC ELECTROLUMINESCENT MATERIAL, THE PROCESS FOR PREPARING THE SAME AND OLED DEVICE USING THE SAME EVERDISPLAY OPTRONICS (SHANGHAI) CO., LTD. (CN) 2015-07-23 US disclosed
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 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 (1 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-20150203485-A1 ORGANIC ELECTROLUMINESCENT MATERIAL, THE PROCESS FOR PREPARING THE SAME AND OLED DEVICE USING THE SAME OCIAD1, OCIAD2, OR10J3 NQO1 338/4885MAPT 3498/4885HPGD 1601/4885

“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.