SCHEMBL13706148

SCHEMBL13706148

CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccccc4)c4ccc5c(ccc6cc(-c7cc8ccccc8cc7-c7ccccc7)ccc65)c4)cc3)cc21

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.34
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
PTGS2 P35354 1/20 0.32
LPL P06858 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL13706143 0.94 HSD17B1 (0.34) HSD17B1HSD17B2PTGS2
SCHEMBL13706230 0.93 PDK2 (0.32) PDK2
SCHEMBL13706145 0.93 GPR84 (0.33) PDK2HSD17B1HSD17B2PTGS2
SCHEMBL24119080 0.91 PDK2 (0.35) PDK2HSD17B1HSD17B2
SCHEMBL20102290 0.91 PDK2 (0.33) PDK2HSD17B1HSD17B2LPLLIPG
SCHEMBL21123722 0.90 PDK2 (0.36) PDK2HSD17B1HSD17B2ESR1ESR2
SCHEMBL14070221 0.90 PDK2 (0.36) PDK2ESR1ESR2
SCHEMBL25089244 0.90 CA12 (0.34) PDK2HSD17B1HSD17B2
SCHEMBL25089256 0.90 CA12 (0.35) PDK2HSD17B1HSD17B2
SCHEMBL25546241 0.90 PDK2 (0.32) PDK2HSD17B1HSD17B2LPLLIPG

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-20090230852-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-09-17 US disclosed
US-20090230852-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2009-09-17 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-20090230852-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same OXER1, L1CAM, RPL41 PDK2 3694/4885HSD17B1 1885/4885HSD17B2 1758/4885

“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.