SCHEMBL3324082

SCHEMBL3324082

COC(=O)c1cccc(OCC(=O)C23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
HPGD P15428 2/20 0.56
HIF1A Q16665 5/20 0.55
EPAS1 Q99814 2/20 0.55
NPSR1 Q6W5P4 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
RAB9A P51151 1/20 0.51
BLM P54132 1/20 0.51
EPHX2 P34913 2/20 0.50
FAAH O00519 2/20 0.50
CNR2 P34972 2/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
HSP90AA1 P07900 1/20 0.48
MDH1 P40925 1/20 0.47
MDH2 P40926 1/20 0.47
EP300 Q09472 1/20 0.47

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
SCHEMBL13333538 0.87 ALDH1A1 (0.53) ALDH1A1HPGDHIF1AEPAS1NPSR1
SCHEMBL3323628 0.86 HIF1A (0.52) ALDH1A1HPGDHIF1AEPAS1NPSR1
SCHEMBL13333542 0.85 HIF1A (0.53) ALDH1A1HPGDHIF1AEPAS1NPSR1
SCHEMBL13333541 0.85 FAAH (0.50) ALDH1A1HPGDNPSR1SMN1; SMN2RAB9A
SCHEMBL13333540 0.85 SMN1; SMN2 (0.52) ALDH1A1HPGDNPSR1SMN1; SMN2RAB9A
SCHEMBL3322896 0.85 HSP90AA1 (0.59) ALDH1A1HIF1AEPAS1SMN1; SMN2NPC1
SCHEMBL15103371 0.77 SMN1; SMN2 (0.58) ALDH1A1HPGDSMN1; SMN2NPC1POLB
SCHEMBL3323990 0.76 MEN1 (0.51) ALDH1A1SMN1; SMN2POLBRAB9ACNR2
SCHEMBL321575 0.76 LMNA (0.66) ALDH1A1SMN1; SMN2NPC1POLBRAB9A
SCHEMBL2832791 0.76 SMN1; SMN2 (0.59) ALDH1A1SMN1; SMN2NPC1POLBRAB9A

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 7 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
EP-1861384-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE INHIBITORS Sterix Limited (GB) 2007-12-05 EP disclosed
WO-2006100502-A1 11-BETA-HYDROXYSTEROID DEHYDROGENASE INHIBITORS STERIX LIMITED (GB) 2006-09-28 WO 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 ALDH1A1 437/4885HPGD 330/4885HIF1A 3036/4885
US-20100120789-A1 Compound NR0B2, NR0B1, NR4A1 ALDH1A1 3143/4885HPGD 3581/4885HIF1A 2504/4885

“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.