SCHEMBL2290967

SCHEMBL2290967

c1ccc([N]c2cccc3c2ccc2ccccc23)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 3/20 0.54
ALDH1A1 P00352 5/20 0.46
HSD17B10 Q99714 4/20 0.46
TDP1 Q9NUW8 3/20 0.46
CYP2A6 P11509 1/20 0.46
TSHR P16473 1/20 0.46
CYP1A2 P05177 5/20 0.45
HPGD P15428 3/20 0.45
THRB P10828 2/20 0.45
MAOA P21397 2/20 0.41
ERBB2 P04626 1/20 0.41
FYN P06241 1/20 0.41
ACHE P22303 1/20 0.41
AHR P35869 1/20 0.41
PAX8 Q06710 1/20 0.41
CYP3A4 P08684 4/20 0.40
HIF1A Q16665 2/20 0.40
ABCB11 O95342 1/20 0.40
NR3C1 P04150 1/20 0.40
ADRA2A P08913 1/20 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
SCHEMBL6541278 0.88 HPRT1 (0.64) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL2328165 0.88 HPRT1 (0.64) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL7751770 0.88 CYP1A2 (0.50) ALDH1A1HSD17B10TDP1CYP2A6TSHR
SCHEMBL69928 0.88 CYP1A2 (0.50) ALDH1A1HSD17B10TDP1CYP2A6TSHR
SCHEMBL6541655 0.86 HPRT1 (0.61) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL30525223 0.79 HPRT1 (0.64) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL6541567 0.79 HPRT1 (0.47) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL2086850 0.78 CYP1A2 (0.47) HPRT1ALDH1A1HSD17B10TDP1TSHR
SCHEMBL17958842 0.78 HPRT1 (0.56) HPRT1ALDH1A1HSD17B10TDP1CYP2A6
SCHEMBL4849424 0.78 ALDH1A1 (0.52) HPRT1ALDH1A1HSD17B10TDP1CYP2A6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed
CN-115403536-A Organic electroluminescent compounds, various host materials and organic electroluminescent device comprising the same 罗门哈斯电子材料韩国有限公司 2022-11-29 CN disclosed
EP-3902021-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH Toyo Ink SC Holdings Co., Ltd. (JP) 2021-10-27 EP disclosed
CN-113228318-A Thermoelectric conversion material and thermoelectric conversion element using same 东洋油墨SC控股株式会社 2021-08-06 CN disclosed
CN-107709297-B Double-spiro organic compound and organic electronic element containing same 株式会社LG化学 2021-06-22 CN disclosed
CN-107428769-B Heterocyclic compound and organic light-emitting element comprising same 株式会社LG化学 2020-03-27 CN disclosed
US-8653279-B2 Dye for dye-sensitized solar cell, and solar cell prepared from same SAMSUNG SDI CO., LTD. (KR) 2014-02-18 US disclosed
US-7989691-B2 Dye for dye-sensitized solar cell and dye-sensitized solar cell including the same SAMSUNG SDI CO., LTD. (KR) 2011-08-02 US disclosed
US-20090293951-A1 DYE FOR DYE-SENSITIZED SOLAR CELL AND DYE-SENSITIZED SOLAR CELL INCLUDING THE SAME SAMSUNG SDI CO., LTD. (KR) 2009-12-03 US disclosed
US-20070240756-A1 Dye for dye-sensitized solar cell, and solar cell prepared from same SAMSUNG SDI CO., LTD. (KR) 2007-10-18 US disclosed
EP-1452574-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT AND ORGANIC ELECTROLUMINESCENCE ELEMENT USING THE SAME TOYO INK MFG. CO., LTD. (JP) 2004-09-01 EP disclosed
US-20040151944-A1 Anode, cathode, light emitting layers TOYO INK MFG. CO., LTD. (JP) 2004-08-05 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 (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-20070240756-A1 Dye for dye-sensitized solar cell, and solar cell prepared from same CRY1, DSG1, CRY2 HPRT1 1580/4885ALDH1A1 543/4885HSD17B10 3074/4885
US-20090293951-A1 DYE FOR DYE-SENSITIZED SOLAR CELL AND DYE-SENSITIZED SOLAR CELL INCLUDING THE SAME EPCAM, DSG1, CRY1 HPRT1 3234/4885ALDH1A1 179/4885HSD17B10 1856/4885

“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.