SCHEMBL5084440

SCHEMBL5084440

C=[C]C1c2ccccc2-c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 2/20 0.41
HTR2A P28223 2/20 0.41
HDAC3 O15379 1/20 0.35
HDAC4 P56524 1/20 0.35
HDAC7 Q8WUI4 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
HDAC9 Q9UKV0 1/20 0.35
HDAC5 Q9UQL6 1/20 0.35
NCOR2 Q9Y618 1/20 0.35
PIM1 P11309 1/20 0.34
CYP1A2 P05177 2/20 0.34
POLB P06746 2/20 0.34
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
ACHE P22303 3/20 0.33
BCHE P06276 2/20 0.33
CHRM2 P08172 1/20 0.33
HTR1A P08908 1/20 0.33
ADRA2A P08913 1/20 0.33

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
SCHEMBL2189907 0.74 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL6648437 0.74 PIM1 (0.56) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL68229 0.74 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL2747277 0.74 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL40598 0.69 GPR3 (0.46) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL28049 0.69 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
Ethylene SCHEMBL6917678 0.68 GPR3 (0.41) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL524603 0.67 GPR3 (0.50) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL29950614 0.67 GPR3 (0.50) GPR3HTR2AHDAC3HDAC4HDAC7
SCHEMBL5434739 0.67 GPR3 (0.35) GPR3HTR2AHDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111018881-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2022-11-01 CN claimed
CN-107428773-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2021-10-08 CN claimed
CN-111018881-A Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2020-04-17 CN claimed
US-20080220286-A1 Electroluminescent compound; high color purity, high fluorescence yield, and high electric luminance yield; easy to synthesize and can easily form films TSINGHUA UNIVERSITY (CN) 2008-09-11 US claimed
CN-111018881-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2022-11-01 CN disclosed
CN-109415315-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2022-06-28 CN disclosed
CN-107428773-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2021-10-08 CN disclosed
CN-107108497-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2021-06-29 CN disclosed
CN-107922421-B Compound for organic electroluminescent device, organic electroluminescent device using the same, and electronic device thereof 德山新勒克斯有限公司 2021-05-07 CN disclosed
CN-107406402-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2021-03-23 CN disclosed
CN-106986835-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2021-02-02 CN disclosed
CN-107531684-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2020-11-24 CN disclosed
CN-108055845-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2020-09-01 CN disclosed
CN-107787314-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2020-06-02 CN disclosed
CN-107849442-B Compound for organic electric element, organic electric element using same, and electronic device using same 德山新勒克斯有限公司 2020-05-19 CN disclosed
CN-108138040-B Compound for organic electroluminescent device, organic electroluminescent device using the same, and electronic device thereof 德山新勒克斯有限公司 2020-04-21 CN disclosed
US-8872422-B2 Dinaphthyl ethylene derivativce, process for preparing it, film prepared from it, and OLED including the film TSINGHUA UNIVERSITY (CN) 2014-10-28 US disclosed
US-20080220286-A1 Electroluminescent compound; high color purity, high fluorescence yield, and high electric luminance yield; easy to synthesize and can easily form films TSINGHUA UNIVERSITY (CN) 2008-09-11 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 (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-20080220286-A1 Electroluminescent compound; high color purity, high fluorescence yield, and high electric luminance yield; easy to synthesize and can easily form films EED, DDT, RABL6 GPR3 3904/4885HTR2A 2991/4885HDAC3 4803/4885

“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.