SCHEMBL10102186

SCHEMBL10102186

Cc1ccc(C(=O)C2CCC(CCO)CC2)cc1OC(C)C

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.37
PDE4B Q07343 4/20 0.36
PDE4D Q08499 3/20 0.36
PDE4A P27815 2/20 0.35
PDE4C Q08493 2/20 0.35
GRM1 Q13255 4/20 0.35
KDM4E B2RXH2 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
CYP2D6 P10635 1/20 0.35
KDM2B Q8NHM5 1/20 0.34
MGLL Q99685 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 0.87 PDE4B (0.45) PDE4BPDE4DPDE4APDE4CKDM4E
SCHEMBL10102194 0.80 MEN1 (0.39) MAPK14PDE4BPDE4DGRM1KMT2A
SCHEMBL10102187 0.80 MEN1 (0.39) MAPK14PDE4BPDE4DGRM1KMT2A
SCHEMBL10102192 0.80 MEN1 (0.39) MAPK14PDE4BPDE4DGRM1KMT2A
SCHEMBL10102177 0.79 SMYD2 (0.37) KDM4EKMT2AMEN1
SCHEMBL659838 0.74 PDE4B (0.48) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL10107127 0.74 PDE4B (0.48) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL4786846 0.74 PDE4B (0.48) PDE4BPDE4DPDE4APDE4CKMT2A
SCHEMBL10101878 0.72 PDE4B (0.47) PDE4BKDM4EL3MBTL1KMT2ANPC1
SCHEMBL16506070 0.71 RORC (0.50) PDE4BPDE4DGRM1KDM4EKMT2A

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 MAPK14 2615/4885PDE4B 823/4885PDE4D 1364/4885

“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.