SCHEMBL3320958

SCHEMBL3320958

CNC(=O)c1ccc(OCC(=O)C23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.52
HSP90AA1 P07900 1/20 0.51
GPR55 Q9Y2T6 1/20 0.51
CNR2 P34972 3/20 0.48
EPHX2 P34913 2/20 0.47
HSD11B1 P28845 1/20 0.47
FAAH O00519 1/20 0.47
HPGD P15428 2/20 0.46
TSHR P16473 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 1/20 0.46
MMP13 P45452 1/20 0.46
MEN1 O00255 1/20 0.45
RAB9A P51151 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL3318135 0.87 HSP90AA1 (0.49) HSP90AA1CNR2EPHX2HSD11B1FAAH
SCHEMBL3319579 0.87 CNR2 (0.49) HSP90AA1CNR2EPHX2HSD11B1FAAH
SCHEMBL3356553 0.86 AOC3 (0.51) HSP90AA1CNR2EPHX2HSD11B1FAAH
SCHEMBL3322896 0.85 HSP90AA1 (0.59) HSP90AA1CNR2EPHX2HSD11B1SMN1; SMN2
SCHEMBL13333538 0.85 ALDH1A1 (0.53) HSP90AA1GPR55CNR2HSD11B1FAAH
SCHEMBL3323551 0.83 HSP90AA1 (0.56) HSP90AA1CNR2HSD11B1FAAHMEN1
SCHEMBL3323184 0.83 RAB9A (0.51) HSP90AA1CNR2EPHX2HSD11B1HPGD
SCHEMBL3322460 0.83 EPHX2 (0.56) HSP90AA1CNR2EPHX2FAAHSMN1; SMN2
SCHEMBL13333535 0.82 MEN1 (0.55) HSP90AA1HSD11B1HPGDHTTALDH1A1
SCHEMBL13333544 0.82 CNR2 (0.49) HSP90AA1CNR2EPHX2HSD11B1HPGD

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
US-20100120789-A1 Compound STERIX LIMITED (GB) 2010-05-13 US disclosed
US-20100120789-A1 Compound STERIX LIMITED (GB) 2010-05-13 US disclosed
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 US disclosed
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 US disclosed
US-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors STERIX LIMITED (GB) 2009-02-12 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 (2 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-20090042929-A1 11-Beta-Hydroxysteroid Dehydrogenase Inhibitors HSD3B1, HSD3B2, HSD11B1 PLK1 4439/4885HSP90AA1 4402/4885GPR55 1017/4885
US-20100120789-A1 Compound NR0B2, NR0B1, NR4A1 PLK1 4241/4885HSP90AA1 4874/4885GPR55 539/4885

“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.