SCHEMBL13706248

SCHEMBL13706248

c1ccc(-c2cc3ccccc3cc2-c2cnc3c(ccc4cc(-c5cccc6ccccc56)cnc43)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.49
TNF P01375 1/20 0.47
CA12 O43570 3/20 0.44
CA9 Q16790 3/20 0.44
PARP1 P09874 1/20 0.43
MAPT P10636 4/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 2/20 0.41
TP53 P04637 1/20 0.41
TSHR P16473 1/20 0.41
NFKB1 P19838 1/20 0.41
MAPK1 P28482 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
ATM Q13315 1/20 0.41
HSD17B10 Q99714 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA1 P00915 2/20 0.40

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
SCHEMBL17899314 0.91 CA12 (0.50) KDM4ETNFCA12CA9PARP1
SCHEMBL13706261 0.89 KDM4E (0.51) KDM4ETNFPARP1ADORA2AADORA1
SCHEMBL13706257 0.89 KDM4E (0.54) KDM4EPARP1ADORA2AADORA1
SCHEMBL13706258 0.86 CYP11B1 (0.51) KDM4EPARP1MAPTALDH1A1SMN1; SMN2
SCHEMBL13706247 0.85 KDM4E (0.60) KDM4EPARP1ADORA2AADORA1
SCHEMBL13706269 0.85 KDM4E (0.43) KDM4ETNFPARP1MAPTSMN1; SMN2
SCHEMBL13706262 0.84 KDM4E (0.59) KDM4EPARP1ADORA2AADORA1
SCHEMBL13706268 0.84 KDM4E (0.58) KDM4EPARP1ADORA2AADORA1
SCHEMBL23954399 0.83 CCR1 (0.53) KDM4ETNFCA12CA9MAPT
SCHEMBL13706249 0.83 KDM4E (0.53) KDM4EPARP1ALDH1A1SMN1; SMN2TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090230852-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-09-17 US disclosed
US-20090230852-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-09-17 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-20090230852-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OXER1, L1CAM, RPL41 KDM4E 4525/4885TNF 4644/4885CA12 2429/4885

“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.