SCHEMBL4249048

SCHEMBL4249048

Cc1ccc(-c2ccc3c(N)c4ccccc4c(N)c3c2-c2ccc(C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.40
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
ACHE P22303 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A1 P04798 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP1B1 Q16678 1/20 0.36
PTGS2 P35354 3/20 0.35
PTGS1 P23219 1/20 0.35
COMT P21964 1/20 0.35
ENPP1 P22413 1/20 0.35
GPR84 Q9NQS5 1/20 0.34
KDM4E B2RXH2 2/20 0.33
HEXA P06865 1/20 0.33
HEXB P07686 1/20 0.33
POLB P06746 1/20 0.33
PPARG P37231 1/20 0.33
MCL1 Q07820 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
SCHEMBL29444809 1.00 ADORA2A (0.40) ADORA2ANPC1RAB9AACHEMEN1
SCHEMBL17600567 0.92 ADORA2A (0.39) ADORA2ANPC1RAB9AACHEMEN1
SCHEMBL27979090 0.89 ADORA2A (0.39) ADORA2ANPC1RAB9AACHEMEN1
SCHEMBL28191145 0.88 ADORA2A (0.36) ADORA2ANPC1RAB9AACHEMEN1
SCHEMBL27937638 0.83 PDE9A (0.36) NPC1RAB9AACHEMEN1KMT2A
SCHEMBL29906503 0.83 PDE9A (0.36) NPC1RAB9AACHEMEN1KMT2A
SCHEMBL29444810 0.83 TNKS (0.34) NPC1RAB9AACHEMEN1KMT2A
SCHEMBL27937723 0.83 TNKS (0.34) NPC1RAB9AACHEMEN1KMT2A
SCHEMBL27979828 0.83 DGAT1 (0.40) ADORA2ANPC1RAB9AKMT2AGPR84
SCHEMBL27888667 0.81 NPC1 (0.39) ADORA2ANPC1RAB9AACHEMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110049990-A polycyclic aromatic amino compound 学校法人关西学院 2019-07-23 CN disclosed
CN-105658606-B Anthracene based compound, luminescent layer material, use its organic electroluminescent device, display device and lighting device 捷恩智株式会社 2018-01-09 CN disclosed
CN-107531641-A Oxazoline ring-containing compound, material for electron transport/injection layer containing the same, and organic electroluminescent element using the same 捷恩智株式会社 2018-01-02 CN disclosed
CN-103328420-B Anthracene compound and use its organic electroluminescent element, luminescent layer material, display device and lighting device 捷恩智株式会社 2017-08-11 CN disclosed
CN-106905367-A Polycyclc aromatic compound, polymer and its manufacture method and its application 学校法人关西学院 2017-06-30 CN disclosed
CN-104040747-A Material for light emitting layers and organic electroluminescent element using same JNC CORP 2014-09-10 CN disclosed
CN-103328420-A Novel anthracene compound and organic electroluminescence element using same JNC CORP 2013-09-25 CN disclosed
CN-101372455-A Arylamine compound and organic light-emitting component using same JIGUANG TECHNOLOGY CORP (CN) 2009-02-25 CN disclosed
US-20090001874-A1 ARYLAMINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING IT Yen, Feng Wen (TW) 2009-01-01 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-20090001874-A1 ARYLAMINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING IT AHR, TYR, SLC7A5 ADORA2A 64/4885NPC1 3002/4885RAB9A 547/4885

“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.