SCHEMBL824175

SCHEMBL824175

CC1(C)c2cc(-c3ccc(Br)cc3)ccc2-c2cc3c(-c4ccccc4)c4ccccc4c(-c4ccccc4)c3cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PDK2 Q15119 3/20 0.36
PTGS2 P35354 1/20 0.32
MCL1 Q07820 1/20 0.32
NPC1 O15118 1/20 0.32
NFKB1 P19838 1/20 0.32
RAB9A P51151 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
PGR P06401 2/20 0.32
TDP2 O95551 3/20 0.31
AGTR1 P30556 1/20 0.31
SLC6A3 Q01959 1/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ACHE P22303 1/20 0.30

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
SCHEMBL2379906 0.93 ALDH1A1 (0.37) MAPK1ALDH1A1PDK2PTGS2TDP2
SCHEMBL2380269 0.91 PDK2 (0.36) MAPK1ALDH1A1PDK2PTGS2KDM4E
SCHEMBL13855113 0.88 PTGS2 (0.35) MAPK1ALDH1A1PDK2PTGS2PGR
SCHEMBL15763802 0.88 ALDH1A1 (0.37) MAPK1ALDH1A1PDK2PGRTDP2
SCHEMBL13819625 0.86 DPP4 (0.36) ALDH1A1PDK2PTGS2KDM4EMAPT
SCHEMBL12560713 0.86 PDK2 (0.39) MAPK1ALDH1A1PDK2NPC1RAB9A
SCHEMBL12560750 0.86 PTGS2 (0.37) MAPK1ALDH1A1PDK2PTGS2PGR
SCHEMBL16621993 0.86 MEN1 (0.40) ALDH1A1PDK2NPC1RAB9ASMN1; SMN2
SCHEMBL2379782 0.86 ALDH1A1 (0.35) MAPK1ALDH1A1PDK2PTGS2
SCHEMBL13819559 0.86 MEN1 (0.40) ALDH1A1PDK2NPC1RAB9ASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143781-B2 Organic electroluminescent compounds with high efficiency and display device using the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-27 US disclosed
US-8143781-B2 Organic electroluminescent compounds with high efficiency and display device using the same ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2012-03-27 US disclosed
US-20110109223-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2011-05-12 US disclosed
US-20110109223-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME GRACEL DISPLAY INC. (KR) 2011-05-12 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-20110109223-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS WITH HIGH EFFICIENCY AND DISPLAY DEVICE USING THE SAME EED, EPHA4, NECTIN4 MAPK1 2989/4885ALDH1A1 216/4885PDK2 2271/4885

“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.