SCHEMBL405626

SCHEMBL405626

c1ccc(-c2ccc3c(n2)-c2cccc4cccc-3c24)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.58
TP53 P04637 4/20 0.58
MAPK1 P28482 4/20 0.58
LMNA P02545 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.58
CCR1 P32246 3/20 0.58
CCR5 P51681 3/20 0.58
CCR8 P51685 3/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
ALOX15 P16050 2/20 0.58
HTT P42858 2/20 0.58
TDP1 Q9NUW8 2/20 0.58
ALPL P05186 1/20 0.58
HSP90AA1 P07900 1/20 0.58
ALPI P09923 1/20 0.58
ALPG P10696 1/20 0.58
PADI1 Q9ULC6 1/20 0.47
PADI3 Q9ULW8 1/20 0.47
PADI4 Q9UM07 1/20 0.47
PADI2 Q9Y2J8 1/20 0.47

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
SCHEMBL10036864 0.79 ALDH1A1 (0.45) KDM4ETP53MAPK1LMNAL3MBTL1
SCHEMBL26260016 0.79 KDM4E (0.58) KDM4ETP53MAPK1LMNAL3MBTL1
SCHEMBL10036870 0.78 NPC1 (0.47) KDM4ETP53MAPK1L3MBTL1TDP1
SCHEMBL19202981 0.78 KDM4E (0.55) KDM4ETP53MAPK1LMNAL3MBTL1
SCHEMBL835463 0.77 KDM4E (0.53) KDM4ETP53MAPK1LMNAL3MBTL1
SCHEMBL10036858 0.77 MAOA (0.44) KDM4ETP53MAPK1L3MBTL1SMN1; SMN2
SCHEMBL30172832 0.76 KDM4E (1.00) KDM4ETP53MAPK1LMNAL3MBTL1
Terpyridine SCHEMBL29357603 0.76 KDM4E (1.00) KDM4ETP53MAPK1LMNAL3MBTL1
Terpyridine SCHEMBL57442 0.76 KDM4E (1.00) KDM4ETP53MAPK1LMNAL3MBTL1
SCHEMBL7964803 0.76 KDM4E (1.00) KDM4ETP53MAPK1LMNAL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101759-B2 Acenaphthopyridine derivative, material of light-emitting element, light-emitting element, light-emitting device, and electronic appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-01-24 US disclosed
US-8101759-B2 Acenaphthopyridine derivative, material of light-emitting element, light-emitting element, light-emitting device, and electronic appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-01-24 US disclosed
US-8101759-B2 Acenaphthopyridine derivative, material of light-emitting element, light-emitting element, light-emitting device, and electronic appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2012-01-24 US disclosed
WO-2009119869-A1 ACENAPHTHOPYRIDINE DERIVATIVE, MATERIAL OF LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC APPLIANCE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2009-10-01 WO disclosed
WO-2009119869-A1 ACENAPHTHOPYRIDINE DERIVATIVE, MATERIAL OF LIGHT-EMITTING ELEMENT, LIGHT-EMITTING ELEMENT, LIGHT-EMITTING DEVICE, AND ELECTRONIC APPLIANCE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2009-10-01 WO disclosed
US-20090247753-A1 Acenaphthopyridine Derivative, Material of Light-Emitting Element, Light-Emitting Element, Light-Emitting Device, and Electronic Appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2009-10-01 US disclosed
US-20090247753-A1 Acenaphthopyridine Derivative, Material of Light-Emitting Element, Light-Emitting Element, Light-Emitting Device, and Electronic Appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2009-10-01 US disclosed
US-20090247753-A1 Acenaphthopyridine Derivative, Material of Light-Emitting Element, Light-Emitting Element, Light-Emitting Device, and Electronic Appliance SEMICONDUCTOR ENERGY LABORATORY CO., LTD. 2009-10-01 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-20090247753-A1 Acenaphthopyridine Derivative, Material of Light-Emitting Element, Light-Emitting Element, Light-Emitting Device, and Electronic Appliance ACE, HRH2, ATP6AP1 KDM4E 2124/4885TP53 4853/4885MAPK1 1810/4885

“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.