SCHEMBL13487283

SCHEMBL13487283

CC1(C)c2ccccc2-c2c(-c3c4ccccc4c(-c4cncnc4)c4ccc(-c5ccc6ccccc6c5)cc34)cccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 9/20 0.37
CYP11B1 P15538 3/20 0.36
CYP11B2 P19099 3/20 0.36
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MAPK9 P45984 1/20 0.33
MAPK10 P53779 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2B6 P20813 1/20 0.33
CYP2C19 P33261 1/20 0.33
BACE1 P56817 3/20 0.31
KCNH2 Q12809 3/20 0.31
ERN1 O75460 1/20 0.31
LPL P06858 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
MET P08581 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
SCHEMBL13487180 0.90 PDK2 (0.38) PDK2CYP11B1CYP11B2KDM4ECYP1A2
SCHEMBL13487114 0.90 PDK2 (0.39) PDK2CYP17A1BACE1KCNH2
SCHEMBL13487279 0.90 CYP11B2 (0.48) PDK2CYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL13487361 0.89 PDK2 (0.39) PDK2BACE1KCNH2
SCHEMBL13487665 0.88 CYP11B2 (0.36) PDK2CYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL13487277 0.88 HSD17B1 (0.37) PDK2CYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL13488054 0.88 CYP11B1 (0.36) PDK2CYP11B1CYP11B2CYP17A1CYP19A1
SCHEMBL13487282 0.86 KDM4E (0.34) CYP11B1CYP11B2CYP17A1CYP19A1KDM4E
SCHEMBL13487270 0.85 PIK3CD (0.34) PDK2KDM4ECYP1A2CYP3A4CYP2C19
SCHEMBL13487294 0.85 ESR1 (0.36) KDM4ECYP1A2CYP3A4CYP2D6CYP2C9

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 PDK2 1456/4885CYP11B1 492/4885CYP11B2 548/4885

“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.