SCHEMBL559155

SCHEMBL559155

Cc1n[c]c2ccccc2c1C

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.35
CYP1A2 P05177 4/20 0.35
CYP2A6 P11509 3/20 0.34
ALDH1A1 P00352 2/20 0.32
PDE10A Q9Y233 1/20 0.32
HPGD P15428 1/20 0.32
NUDT1 P36639 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.32
NPC1 O15118 1/20 0.32
HSP90AA1 P07900 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
AHR P35869 1/20 0.31
HTT P42858 1/20 0.30

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
SCHEMBL639857 0.71 CYP2A6 (0.38) GPR3CYP1A2CYP2A6ALDH1A1HPGD
SCHEMBL2336588 0.70 CYP1A2 (0.41) GPR3CYP1A2CYP2A6ALDH1A1HPGD
SCHEMBL24030 0.70 GPR3 (0.46) GPR3CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL2514483 0.68 LMNA (0.37) CYP1A2ALDH1A1HPGDHSD17B10NPC1
SCHEMBL27656095 0.68 GPR3 (0.44) GPR3CYP1A2ALDH1A1HPGDHSD17B10
SCHEMBL558999 0.67 MAOA (0.37) CYP1A2CYP2A6
SCHEMBL857662 0.67 LMNA (0.39) GPR3CYP1A2ALDH1A1HPGDNUDT1
SCHEMBL1070656 0.67 IDO1 (0.33) ALDH1A1
SCHEMBL2358500 0.67 CYP1A2 (0.39) GPR3CYP1A2CYP2A6ALDH1A1TSHR
SCHEMBL9218409 0.66 ALDH1A1 (0.45) CYP1A2ALDH1A1

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 240 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108997438-B Red phosphorescent compound and organic light emitting diode device using the same 浙江华显光电科技有限公司 2023-10-27 CN claimed
CN-108997437-B Red phosphorescent compound and organic light emitting diode device using the same 浙江华显光电科技有限公司 2023-10-20 CN claimed
CN-109988193-B Green phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2021-11-16 CN claimed
CN-109810146-B Green phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2021-11-16 CN claimed
CN-111116673-A Red phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2020-05-08 CN claimed
CN-110981913-A Green phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2020-04-10 CN claimed
CN-110964063-A Green phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2020-04-07 CN claimed
CN-110938097-A Green phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2020-03-31 CN claimed
CN-110922430-A Green phosphorescent compound and organic electroluminescent device using same 宇瑞(上海)化学有限公司 2020-03-27 CN claimed
CN-110872328-A Red phosphorescent compound and organic electroluminescent device using the same 浙江华显光电科技有限公司 2020-03-10 CN claimed
US-20060204785-A1 Dopant iridium complexes of 2-alkylphenylquinolines and an alkanedione; dopant of the light emitting layer; host compounds are aluminum or zinc complexes; high color purity, high brightness, and long durability; flat panel displays LG ELECTRONICS INC. (KR) 2006-09-14 US claimed
WO-2006095943-A1 RED PHOSPHORESCENE COMPOUNDS AND ORGANIC ELECTROLUMINESCENCE DEVICES USING THE SAME LG ELECTRONICS INC. (KR) 2006-09-14 WO claimed
EP-1521758-B1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEM PATENTS INC (US) 2006-05-24 EP claimed
US-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization EXXONMOBIL CHEMICAL PATENTS INC. 2006-03-02 US claimed
JP-2006503013-A 2006-01-26 JP claimed
EP-1532149-A2 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-05-25 EP claimed
EP-1521758-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION Exxonmobil Chemical Patents Inc. (US) 2005-04-13 EP claimed
US-20040097510-A1 8-[3-amino-piperidin-1-yl]-xanthines, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-05-20 US claimed
WO-2004018468-A2 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-04 WO claimed
WO-2004007509-A1 LATE TRANSITION METAL CATALYSTS FOR OLEFIN POLYMERIZATION AND OLIGOMERIZATION EXXONMOBIL CHEMICAL PATENTS INC. (US) 2004-01-22 WO claimed

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-20060047094-A1 Late transition metal catalysts for olefin polymerization and oligomerization MLX, LOX, LMTK3 GPR3 1918/4885CYP1A2 2390/4885CYP2A6 2765/4885
US-20060204785-A1 Dopant iridium complexes of 2-alkylphenylquinolines and an alkanedione; dopant of the light emitting layer; host compounds are aluminum or zinc complexes; high color purity, high brightness, and long durability; flat panel displays KCNQ5, KCNN1, SLC7A5 GPR3 3870/4885CYP1A2 952/4885CYP2A6 3700/4885
US-20040097510-A1 8-[3-amino-piperidin-1-yl]-xanthines, the preparation thereof and their use as pharmaceutical compositions DPP8, DPP4, DPP3 GPR3 752/4885CYP1A2 313/4885CYP2A6 702/4885

“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.