SCHEMBL1869099

SCHEMBL1869099

C[Si](C)(C)OCC(CO[Si](C)(C)C)OC(=O)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRKCA P17252 1/20 0.57
CYP17A1 P05093 7/20 0.52
CYP19A1 P11511 7/20 0.52
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
ALDH1A1 P00352 4/20 0.41
ATM Q13315 2/20 0.41
PKM P14618 1/20 0.39
MAPT P10636 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
SCN1A P35498 1/20 0.37
SCN2A Q99250 1/20 0.37
SCN3A Q9NY46 1/20 0.37
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
GAA P10253 1/20 0.36
XBP1 P17861 1/20 0.36
CA2 P00918 1/20 0.36
HSD11B1 P28845 1/20 0.36

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
SCHEMBL1864534 0.76 PRKCA (0.78) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL14488494 0.73 CYP17A1 (0.50) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL16731832 0.72 CYP17A1 (0.55) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL19475250 0.71 CYP17A1 (0.54) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL2754983 0.70 PRKCA (0.51) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL10531426 0.70 PRKCA (0.51) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL16731843 0.70 PRKCA (0.51) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL13447507 0.70 PRKCA (0.61) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL16941753 0.70 PRKCA (0.54) PRKCACYP17A1CYP19A1MEN1KMT2A
SCHEMBL26011236 0.70 PRKCA (0.48) PRKCACYP17A1CYP19A1MEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1935879-B1 SUBSTITUTED CYCLOALKENE DERIVATIVE DAIICHI SANKYO CO LTD (JP) 2016-05-11 EP disclosed
US-RE43858-E1 Substituted cycloalkene derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-12-11 US disclosed
US-7935835-B2 Substituted cycloalkene derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2011-05-03 US disclosed
US-20090233952-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-09-17 US disclosed
EP-1935879-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2008-06-25 EP 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-20090233952-A1 SUBSTITUTED CYCLOALKENE DERIVATIVE CD40, LITAF, TNF PRKCA 703/4885CYP17A1 1456/4885CYP19A1 2524/4885

“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.