SCHEMBL1103217

SCHEMBL1103217

Cc1cc(-c2c3ccccc3c(-c3cccc4ccccc34)c3ncccc23)cc(C)c1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 4/20 0.47
CCR8 P51685 4/20 0.47
DYRK1A Q13627 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.39
CCR5 P51681 2/20 0.39
NPC1 O15118 1/20 0.39
HSP90AA1 P07900 1/20 0.39
DHFR P00374 1/20 0.39
SLC40A1 Q9NP59 1/20 0.38
ACHE P22303 1/20 0.38
NUDT1 P36639 1/20 0.38
ALDH1A1 P00352 4/20 0.37
HPGD P15428 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GSK3B P49841 1/20 0.37
CDK5 Q00535 1/20 0.37
CDK5R1 Q15078 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
SCHEMBL1103216 0.88 CCR1 (0.46) CCR1CCR8DYRK1AL3MBTL1CCR5
SCHEMBL1103207 0.88 CCR1 (0.44) CCR1CCR8DYRK1AL3MBTL1CCR5
SCHEMBL1103218 0.86 COMT (0.46) CCR1CCR8L3MBTL1CCR5NPC1
SCHEMBL1103008 0.86 L3MBTL1 (0.48) CCR1CCR8DYRK1AL3MBTL1CCR5
SCHEMBL1103214 0.84 ENPP1 (0.47) CCR1CCR8L3MBTL1CCR5DHFR
SCHEMBL1103186 0.84 TOP1 (0.39) CCR1CCR8L3MBTL1CCR5NPC1
SCHEMBL1103215 0.83 CCR1 (0.47) CCR1CCR8L3MBTL1CCR5NPC1
SCHEMBL1103087 0.83 KDM4E (0.42) CCR1CCR8L3MBTL1CCR5NPC1
SCHEMBL1102865 0.83 KDM4E (0.47) CCR1CCR8L3MBTL1CCR5NPC1
SCHEMBL13512523 0.83 KDM4E (0.50) CCR1CCR8L3MBTL1CCR5NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 US disclosed
EP-2147962-A1 Azaanthracene-derivatives and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-01-27 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-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 CCR1 1341/4885CCR8 1581/4885DYRK1A 4241/4885

“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.