SCHEMBL1102529

SCHEMBL1102529

CC(C)c1ccc2c(c1)C(C)(C)c1cc(-c3c4ccccc4c(-c4ccc5ccccc5c4)c4ccncc34)ccc1-2

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.36
CYP19A1 P11511 1/20 0.36
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
AKR1C3 P42330 2/20 0.35
AKR1C2 P52895 2/20 0.35
KDR P35968 1/20 0.35
TDO2 P48775 2/20 0.34
PDK2 Q15119 1/20 0.34
MAPK9 P45984 3/20 0.33
MAPK10 P53779 3/20 0.33
DGAT2 Q96PD7 2/20 0.33
SLC22A12 Q96S37 1/20 0.33
MAPK8 P45983 1/20 0.33
CCNC P24863 7/20 0.33
CDK8 P49336 7/20 0.33

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
SCHEMBL1102467 0.94 PDK2 (0.35) CYP17A1CYP19A1CYP11B1CYP11B2AKR1C3
SCHEMBL1102676 0.92 CYP11B1 (0.41) CYP17A1CYP19A1CYP11B1CYP11B2TDO2
SCHEMBL1102592 0.91 PDK2 (0.35) AKR1C3AKR1C2KDRPDK2DGAT2
SCHEMBL1102782 0.91 CYP11B2 (0.43) CYP17A1CYP19A1CYP11B1CYP11B2TDO2
SCHEMBL1102594 0.91 KDR (0.39) CYP11B1CYP11B2AKR1C3AKR1C2KDR
SCHEMBL1102725 0.89 CYP11B1 (0.39) CYP17A1CYP19A1CYP11B1CYP11B2TDO2
SCHEMBL1102647 0.89 CYP11B1 (0.42) CYP17A1CYP19A1CYP11B1CYP11B2TDO2
SCHEMBL1102465 0.88 DGAT2 (0.36) CYP17A1AKR1C3AKR1C2KDRPDK2
SCHEMBL1102570 0.87 KDR (0.36) AKR1C3AKR1C2KDRPDK2DGAT2
SCHEMBL10072718 0.87 CYP17A1 (0.37) CYP17A1CYP19A1CYP11B1CYP11B2TDO2

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-8153279-B2 Organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2012-04-10 US disclosed
US-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same GRACEL DISPLAY INC. (KR) 2010-02-11 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-20100033083-A1 Novel organic electroluminescent compounds and organic electroluminescent device using the same ORMDL3, OCIAD2, OCIAD1 CYP17A1 2034/4885CYP19A1 1424/4885CYP11B1 836/4885

“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.