SCHEMBL6006369

SCHEMBL6006369

c1ccc2cc([N]c3cccc4ccccc34)ccc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
HSD17B10 Q99714 4/20 0.44
CYP1A2 P05177 4/20 0.44
TDP1 Q9NUW8 2/20 0.44
HPGD P15428 2/20 0.44
HTR3E A5X5Y0 2/20 0.44
HTR3B O95264 2/20 0.44
HTR3A P46098 2/20 0.44
HTR3D Q70Z44 2/20 0.44
HTR3C Q8WXA8 2/20 0.44
MAOA P21397 2/20 0.44
CYP3A4 P08684 2/20 0.44
ABCB11 O95342 1/20 0.44
NR3C1 P04150 1/20 0.44
ADRA2A P08913 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
ALOX15 P16050 1/20 0.44
ADRA2C P18825 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A4 P31645 1/20 0.44

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
SCHEMBL2291747 0.83 MEN1 (0.55) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL23257818 0.81 MEN1 (0.58) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL69928 0.79 CYP1A2 (0.50) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL7751770 0.79 CYP1A2 (0.50) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL1354442 0.79 HTR3E (0.58) ALDH1A1HSD17B10CYP1A2TDP1HTR3E
SCHEMBL49212 0.79 ALDH1A1 (0.58) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL2582570 0.78 SIGMAR1 (0.49) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL5145155 0.77 RAB9A (0.51) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL2254008 0.76 SIGMAR1 (0.49) ALDH1A1HSD17B10CYP1A2TDP1HPGD
SCHEMBL6541655 0.74 HPRT1 (0.61) ALDH1A1HSD17B10CYP1A2TDP1HPGD

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
CN-1734792-A Molecular photovoltaics, method of manufacture and articles derived therefrom GEN ELECTRIC (US) 2006-02-15 CN claimed
CN-100570923-C OLED lamp and manufacture method thereof EASTMAN KODAK CO (US) 2009-12-16 CN disclosed
CN-1734792-A Molecular photovoltaics, method of manufacture and articles derived therefrom GEN ELECTRIC (US) 2006-02-15 CN disclosed
EP-1207161-B1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMA CO LTD (JP) 2006-01-18 EP disclosed
US-6777410-B2 SUCH AS 9-(2-METHOXYPHENYL)-3-(1-METHYLETHYL)-(1,3)OXAZOLO-(2,3)ISOINDOLE-2,5(3H,9H)-DIONE; DIABETES AND COMPLICATIONS; OBESITY BANYU PHARMACEUTICAL CO., LTD. (JP) 2004-08-17 US disclosed
CN-1497750-A OLED lamp ��˹���´﹫˾ 2004-05-19 CN disclosed
CN-1498050-A High-power function metal alloy cathode used in organic electroluminescence device ��˹���´﹫˾ 2004-05-19 CN disclosed
US-20040053923-A1 Novel isoindole derivatives BANYU PHARMACEUTICAL CO., LTD. 2004-03-18 US disclosed
US-6608098-B1 Diabetes or obesity, 2-(4-(3-isopropyl-2,5-dioxo-2,3-dihydro-1H-pyrrolo(2,1-a) isoindol-9(5H)-yl)phenoxy)-N-propylacetamide BANYU PHARMACEUTICAL CO., LTD. (JP) 2003-08-19 US disclosed
EP-1207161-A1 NOVEL ISOINDOLE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2002-05-22 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-20040053923-A1 Novel isoindole derivatives GPR119, SLC5A2, SLC5A1 ALDH1A1 228/4885HSD17B10 418/4885CYP1A2 68/4885

“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.