SCHEMBL9697154

SCHEMBL9697154

c1ccc(-c2cccc(-c3ncccn3)c2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 2/20 0.53
DYRK1A Q13627 1/20 0.53
GP6 Q9HCN6 1/20 0.52
NPC1 O15118 1/20 0.50
NFKB1 P19838 1/20 0.50
RAB9A P51151 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
KMO O15229 1/20 0.48
CYP2A6 P11509 1/20 0.46
NISCH Q9Y2I1 1/20 0.46
MAOA P21397 1/20 0.44
NOTUM Q6P988 1/20 0.44
KAT6A Q92794 1/20 0.44
ADRB2 P07550 1/20 0.43
ALDH1A1 P00352 1/20 0.43
HCRTR1 O43613 1/20 0.43
HCRTR2 O43614 1/20 0.43
GRM5 P41594 1/20 0.42

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
SCHEMBL21982136 0.94 CLK4 (0.48) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL18327488 0.94 CLK4 (0.48) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL29637608 0.90 CLK4 (0.57) CLK4DYRK1AGP6NPC1RAB9A
SCHEMBL14961829 0.90 CLK4 (0.61) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL17720980 0.90 MEN1 (0.47) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL18327459 0.90 MEN1 (0.47) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL19075008 0.90 MEN1 (0.47) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL19009562 0.88 MEN1 (0.56) CLK4DYRK1AGP6SMN1; SMN2KMO
SCHEMBL18327356 0.87 MEN1 (0.48) CLK4DYRK1AGP6NPC1NFKB1
SCHEMBL19039933 0.87 MEN1 (0.48) CLK4DYRK1AGP6NPC1NFKB1

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-114583067-A Quantum dot light-emitting diode, display device and light-emitting light source TCL科技集团股份有限公司 2022-06-03 CN claimed
CN-114520292-A Quantum dot light-emitting diode, display device and light-emitting light source TCL科技集团股份有限公司 2022-05-20 CN claimed
WO-1992001766-A1 FERROELECTRIC LIQUID CRYSTAL COMPOSITIONS CONTAINING HALOGENATED CORES AND CHIRAL HALOALKOXY TAIL UNITS DISPLAYTECH, INC. (US) 1992-02-06 WO claimed
CN-114583067-A Quantum dot light-emitting diode, display device and light-emitting light source TCL科技集团股份有限公司 2022-06-03 CN disclosed
CN-114520292-A Quantum dot light-emitting diode, display device and light-emitting light source TCL科技集团股份有限公司 2022-05-20 CN disclosed
US-10844086-B2 Method for producing halogen-crosslinked iridium dimer NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) 2020-11-24 US disclosed
US-9666806-B2 Formulations for the production of electronic devices MERCK PATENT GMBH (DE) 2017-05-30 US disclosed
EP-2168576-A2 New utilities of tricyclic compounds Shionogi & Co., Ltd. (JP) 2010-03-31 EP disclosed
US-20080318958-A1 New utilities of tricyclic compounds ISHIZUKA NATSUKI 2008-12-25 US disclosed
US-20080318958-A1 New utilities of tricyclic compounds ISHIZUKA NATSUKI 2008-12-25 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-10844086-B2 Method for producing halogen-crosslinked iridium dimer CYBA, CYBB, PPIB CLK4 639/4885DYRK1A 49/4885GP6 2034/4885
US-20080318958-A1 New utilities of tricyclic compounds APOB, PON1, APOL1 CLK4 4118/4885DYRK1A 4365/4885GP6 1772/4885

“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.