SCHEMBL659170

SCHEMBL659170

COc1ccc(C(=O)C2CCC(CCOCC(C)(C)[SiH](c3ccccc3)c3ccccc3)CC2)cc1OC(C)C

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 8/20 0.38
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
PDE4D Q08499 7/20 0.35
PDE4A P27815 6/20 0.35
PDE4C Q08493 6/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
KDM2B Q8NHM5 1/20 0.35
KDM4E B2RXH2 2/20 0.34
LMNA P02545 1/20 0.34
PKM P14618 1/20 0.34
MAPT P10636 1/20 0.34
MAPK1 P28482 1/20 0.34

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
SCHEMBL660730 0.78 PDE4B (0.45) PDE4BKMT2AMEN1PDE4DPDE4A
SCHEMBL14042205 0.75 PDE4B (0.38) PDE4BKMT2AMEN1PDE4DPDE4A
SCHEMBL10102177 0.69 SMYD2 (0.37) KMT2AMEN1ALDH1A1GAAKDM4E
SCHEMBL10413533 0.67 CYP1A2 (0.61) PDE4BKMT2AMEN1PDE4DALDH1A1
SCHEMBL10102186 0.67 MAPK14 (0.37) PDE4BKMT2AMEN1PDE4DPDE4A
SCHEMBL3924278 0.63 CA12 (0.73) PDE4BKMT2APDE4DPDE4APDE4C
SCHEMBL4786846 0.63 PDE4B (0.48) PDE4BKMT2AMEN1PDE4DPDE4A
SCHEMBL659838 0.63 PDE4B (0.48) PDE4BKMT2AMEN1PDE4DPDE4A
SCHEMBL10107127 0.63 PDE4B (0.48) PDE4BKMT2AMEN1PDE4DPDE4A
SCHEMBL16506070 0.63 RORC (0.50) PDE4BKMT2AMEN1PDE4DALDH1A1

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-8536157-B2 Non-steroidal compounds THE UNIVERSITY OF MELBOURNE (AU) 2013-09-17 US disclosed
US-20120046255-A1 NON-STEROIDAL COMPOUNDS THE UNIVERSITY OF MELBOURNE of ROYAL PARADE PARKVILLE (AU) 2012-02-23 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-20120046255-A1 NON-STEROIDAL COMPOUNDS PTGES2, PTGES, PTGES3 PDE4B 823/4885KMT2A 4832/4885MEN1 3782/4885

“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.