SCHEMBL1483335

SCHEMBL1483335

CC(=O)OC1CCC2(C)C(CCC3C2CCC2(C)C(C4=CC(=O)OC4)CCC32O)C1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 5/20 0.74
SMN1; SMN2 Q16637 4/20 0.74
ATP1A1 P05023 13/20 0.74
ATP1B1 P05026 13/20 0.74
ATP1A3 P13637 13/20 0.74
ATP1B2 P14415 13/20 0.74
ATP1A2 P50993 13/20 0.74
ATP1B3 P54709 13/20 0.74
FXYD2 P54710 13/20 0.74
ATP1A4 Q13733 13/20 0.74
LMNA P02545 3/20 0.74
PAX8 Q06710 2/20 0.74
NPC1 O15118 2/20 0.74
RAB9A P51151 2/20 0.74
CYP3A4 P08684 1/20 0.74
TSHR P16473 1/20 0.74
HIF1A Q16665 1/20 0.74
ATP12A P54707 1/20 0.74
HBB P68871 1/20 0.66
USP2 O75604 1/20 0.65

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
SCHEMBL26042802 1.00 TP53 (0.74) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL21681745 1.00 TP53 (0.74) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL21578398 1.00 TP53 (0.74) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL1483332 1.00 TP53 (0.74) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL12370059 1.00 TP53 (0.74) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL12557040 0.90 ATP1A1 (0.78) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL13762512 0.90 ATP1A1 (0.69) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL17864012 0.88 ATP1A1 (0.75) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL11648611 0.88 TP53 (0.59) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3
SCHEMBL15354321 0.88 SMN1; SMN2 (0.68) TP53SMN1; SMN2ATP1A1ATP1B1ATP1A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110076278-A1 Modulators of Hypoxia Inducible Factor-1 and Related Uses for the Treatment of Ocular Disorders BIONAUT PHARMACEUTICALS INC 2011-03-31 US claimed
EP-1928470-A2 MODULATORS OF HYPOXIA INDUCIBLE FACTOR-1 AND RELATED USES FOR THE TREATMENT OF OCULAR DISORDERS Bionaut Pharmaceuticals (US) 2008-06-11 EP claimed
WO-2007016656-A2 MODULATORS OF HYPOXIA INDUCIBLE FACTOR-1 AND RELATED USES FOR THE TREATMENT OF OCULAR DISORDERS BTG INTERNATIONAL LIMITED (GB) 2007-02-08 WO claimed
EP-0684256-B1 Improved process for the preparation of 3 beta, 14 beta-dihydroxyethialnaldehyde SIGMA TAU IND FARMACEUTI (IT) 1998-05-13 EP claimed
US-5596110-A Process for the preparation of 3 β, 14 β-dihydroxyethianaldehyde SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 1997-01-21 US claimed
EP-0684256-A2 Improved process for the preparation of 3 beta, 14 beta-dihydroxyethialnaldehyde Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 1995-11-29 EP claimed
US-20110076278-A1 Modulators of Hypoxia Inducible Factor-1 and Related Uses for the Treatment of Ocular Disorders BIONAUT PHARMACEUTICALS INC 2011-03-31 US disclosed
EP-1928470-A2 MODULATORS OF HYPOXIA INDUCIBLE FACTOR-1 AND RELATED USES FOR THE TREATMENT OF OCULAR DISORDERS Bionaut Pharmaceuticals (US) 2008-06-11 EP disclosed
WO-2007016656-A2 MODULATORS OF HYPOXIA INDUCIBLE FACTOR-1 AND RELATED USES FOR THE TREATMENT OF OCULAR DISORDERS BTG INTERNATIONAL LIMITED (GB) 2007-02-08 WO disclosed
EP-0684256-B1 Improved process for the preparation of 3 beta, 14 beta-dihydroxyethialnaldehyde SIGMA TAU IND FARMACEUTI (IT) 1998-05-13 EP disclosed
US-5596110-A Process for the preparation of 3 β, 14 β-dihydroxyethianaldehyde SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 1997-01-21 US disclosed
EP-0684256-A2 Improved process for the preparation of 3 beta, 14 beta-dihydroxyethialnaldehyde Sigma-Tau Industrie Farmaceutiche Riunite S.p.A. (IT) 1995-11-29 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-20110076278-A1 Modulators of Hypoxia Inducible Factor-1 and Related Uses for the Treatment of Ocular Disorders HIF1A, HIF1AN, HYOU1 TP53 2477/4885SMN1; SMN2 3333/4885ATP1A1 307/4885

“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.