SCHEMBL13487259

SCHEMBL13487259

CC1(C)c2ccccc2-c2c(-c3c4ccccc4c(-c4cccc5oc6ccccc6c45)c4ccc(-c5ccc6ccccc6c5)cc34)cccc21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
HCRTR1 O43613 1/20 0.33
LPL P06858 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
PTGER3 P43115 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
CYP1A1 P04798 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CHRNA1 P02708 1/20 0.30
CHRNG P07510 1/20 0.30
CHRNB1 P11230 1/20 0.30
CHRNB2 P17787 1/20 0.30
SLC6A2 P23975 1/20 0.30
CHRNB4 P30926 1/20 0.30
SLC6A4 P31645 1/20 0.30
CHRNA3 P32297 1/20 0.30
CHRNA4 P43681 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
SCHEMBL13487262 0.91 CASP3 (0.34) CASP3SENP7SENP6HCRTR1LPL
SCHEMBL13487161 0.91 CHRNA1 (0.32) TDP1L3MBTL1CHRNA1CHRNGCHRNB1
SCHEMBL13487097 0.90 PLA2G2A (0.35) CASP3SENP7SENP6HCRTR1
SCHEMBL13487659 0.90 CASP3 (0.32) CASP3SENP7SENP6HCRTR1LPL
SCHEMBL13488037 0.90 CASP3 (0.32) CASP3SENP7SENP6HCRTR1LPL
SCHEMBL13487342 0.89 PDK2 (0.31)
SCHEMBL13487260 0.89 ALOX5 (0.40) CASP3SENP7SENP6HCRTR1LPL
SCHEMBL24285500 0.85 MAOA (0.33) SLC6A2SLC6A4
SCHEMBL13487039 0.84 MAOB (0.33)
SCHEMBL24481509 0.83 ABCG2 (0.33) TDP1L3MBTL1CYP1A1

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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 US disclosed
US-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-25 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-20100045170-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OCIAD1, OCIAD2, ORMDL3 CASP3 3093/4885SENP7 3726/4885SENP6 3542/4885

“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.