SCHEMBL4474776

SCHEMBL4474776

O=C1c2cccc(Sc3ccccc3-c3ccccc3)c2C(=O)c2cccc(Sc3ccccc3-c3ccccc3)c21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.61
MAPK1 P28482 3/20 0.61
NSD2 O96028 2/20 0.61
KDM4E B2RXH2 1/20 0.61
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
ALDH1A1 P00352 4/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
ADORA2A P29274 3/20 0.40
MAOA P21397 1/20 0.39
BACE1 P56817 1/20 0.39
HTR7 P34969 1/20 0.39
HNF4A P41235 1/20 0.38
EGFR P00533 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
LMNA P02545 2/20 0.37
PABPC1 P11940 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL11421896 0.84 MAPT (0.69) MAPTMAPK1NSD2KDM4EALDH1A1
SCHEMBL4480618 0.82 MAPT (0.72) MAPTMAPK1NSD2KDM4EHDAC4
SCHEMBL1782448 0.82 HTR7 (0.50) MAPTMAPK1NSD2KDM4EHDAC4
SCHEMBL4465042 0.81 MAPT (0.89) MAPTMAPK1NSD2KDM4EALDH1A1
SCHEMBL285567 0.78 MAPT (0.89) MAPTMAPK1NSD2KDM4EALDH1A1
Anthraquinone SCHEMBL11411972 0.78 MAPT (0.89) MAPTMAPK1NSD2KDM4EALDH1A1
SCHEMBL30475313 0.78 MAPT (0.89) MAPTMAPK1NSD2KDM4EALDH1A1
SCHEMBL6366580 0.78 ADORA2A (0.58) MAPTMAPK1NSD2KDM4EALDH1A1
SCHEMBL4469259 0.78 MAPK1 (0.56) MAPTMAPK1NSD2KDM4EALDH1A1
SCHEMBL11424452 0.78 HDAC4 (0.52) MAPTMAPK1NSD2HDAC4HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7494721-B2 Light-emitting device, condensed polycyclic compound used therein and method for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-02-24 US disclosed
US-20060051612-A1 Light-emitting device, condensed polycyclic compound used therein and method for producing same NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2006-03-09 US disclosed
EP-1589089-A1 LIGHT-EMITTING DEVICE, CONDENSED POLYCYCLIC COMPOUND USED THEREIN AND METHOD FOR PRODUCING SAME Nippon Kayaku Kabushiki Kaisha (JP) 2005-10-26 EP 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-20060051612-A1 Light-emitting device, condensed polycyclic compound used therein and method for producing same CYBA, SCO2, NQO1 MAPT 2457/4885MAPK1 2071/4885NSD2 941/4885

“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.