SCHEMBL13488104

SCHEMBL13488104

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(-c5ccc6sc7ccccc7c6c5)c5ccccc5c(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)c4c3)cc21

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
POLB P06746 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX5 P09917 1/20 0.33
PDK2 Q15119 8/20 0.32
ALK Q9UM73 1/20 0.31
PTPN7 P35236 1/20 0.31
DUSP3 P51452 1/20 0.31
PTPN12 Q05209 1/20 0.31
PTPN22 Q9Y2R2 1/20 0.31
PIM3 Q86V86 1/20 0.30
F9 P00740 1/20 0.30
HSP90AA1 P07900 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
SCHEMBL13487882 0.96 PDK2 (0.37) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL13487721 0.96 ALDH1A1 (0.34) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL21687079 0.96 GPR3 (0.37) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL17944680 0.94 ALDH1A1 (0.36) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL13488031 0.93 S1PR5 (0.32) ALKPTPN7DUSP3PTPN12PTPN22
SCHEMBL13487340 0.93 ALOX5 (0.32) ALOX5PDK2
SCHEMBL13488240 0.93 PDK2 (0.34) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL13487818 0.93 PDK2 (0.34) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL18086207 0.92 GPR3 (0.40) GPR3ALDH1A1MAPTHPGDRAB9A
SCHEMBL13487953 0.91 F9 (0.34) ALOX5F9

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 GPR3 2804/4885ALDH1A1 101/4885MAPT 2219/4885

“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.