SCHEMBL13008186

SCHEMBL13008186

c1ccc(-c2ccc3cc(-c4c5ccc(N6c7ccccc7Cc7ccccc76)cc5c(-c5ccccc5)c5ccc(N6c7ccccc7Cc7ccccc76)cc45)ccc3c2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.37
ESR2 Q92731 3/20 0.37
HPGD P15428 1/20 0.35
HSD17B1 P14061 3/20 0.34
HSD17B2 P37059 3/20 0.34
CYP1A2 P05177 2/20 0.34
CYP3A4 P08684 2/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2B6 P20813 2/20 0.34
CYP2C19 P33261 2/20 0.34
NR3C1 P04150 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
HSD17B3 P37058 1/20 0.31
PDE6D O43924 1/20 0.31
DHFR P00374 1/20 0.31
HTR2A P28223 1/20 0.30
HTR2C P28335 1/20 0.30
HRH1 P35367 1/20 0.30
FAAH O00519 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
SCHEMBL13009318 0.96 ESR1 (0.35) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13426972 0.96 ESR1 (0.36) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13426984 0.96 HPGD (0.35) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13426994 0.95 ESR1 (0.36) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13008787 0.95 HPGD (0.35) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13009395 0.95 HPGD (0.35) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13426965 0.94 HSD17B1 (0.35) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13008778 0.94 ESR1 (0.36) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13428149 0.93 HSD17B3 (0.38) ESR1ESR2HPGDHSD17B1HSD17B2
SCHEMBL13009302 0.92 HPGD (0.41) ESR1ESR2HPGDHSD17B3PDE6D

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
EP-2256176-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same Gracel Display Inc. (KR) 2010-12-01 EP disclosed
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 US disclosed
US-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-03-04 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-20100051106-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same RPL36, RPL39, RPL36A ESR1 612/4885ESR2 171/4885HPGD 4470/4885

“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.