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Sugi Predict / Compounds / Diflucortolone 21-Valerate

Diflucortolone 21-Valerate

Diflucortolone 21-Valerate

SCHEMBL2790985

CCCCC(=O)OCC(=O)[C@H]1[C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C.CCCCC(=O)OCC(=O)[C@H]1[C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 8/20 0.73
▸ NR1I2 O75469 3/20 0.73
▸ HTR2B P41595 1/20 0.73
▸ HIF1A Q16665 7/20 0.63
▸ AR P10275 7/20 0.63
▸ CYP3A4 P08684 5/20 0.63
▸ ADORA3 P0DMS8 3/20 0.63
▸ LMNA P02545 2/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ NR3C1 P04150 9/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ NR3C2 P08235 1/20 0.53
▸ CHRM1 P11229 2/20 0.53
▸ ABCB11 O95342 2/20 0.53
▸ ADRA1A P35348 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ RAB9A P51151 1/20 0.52

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
Diflucortolone 21-Valerate SCHEMBL13157 1.00 PGR (0.73) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL9388448 1.00 PGR (0.73) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL3015 1.00 PGR (0.73) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL1021717 1.00 PGR (0.73) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL11243011 1.00 PGR (0.73) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL13158 1.00 PGR (0.73) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL16338435 0.99 PGR (0.72) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL679499 0.99 PGR (0.72) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL4454848 0.99 PGR (0.72) PGRNR1I2HTR2BHIF1AAR
Diflucortolone 21-Valerate SCHEMBL15312089 0.99 PGR (0.72) PGRNR1I2HTR2BHIF1AAR

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
WO-2023187228-A1 MULTIHETERODYNE DUAL-COMB OPTODE FOR DETECTING HEMODYNAMIC AND BLOOD FLOW CHANGES IN DIFFUSE TISSUES ARICO SCIENCE, A.I.E. (ES) 2023-10-05 — — WO disclosed
EP-2768386-A1 MAGNETIC RESONANCE MAPS FOR ANALYZING TISSUE Tel HaShomer Medical Research Infrastructure and Services Ltd. (IL) 2014-08-27 — — EP disclosed
WO-2013057697-A1 MAGNETIC RESONANCE MAPS FOR ANALYZING TISSUE TEL HASHOMER MEDICAL RESEARCH INFRASTRUCTURE AND SERVICES LTD. (IL) 2013-04-25 — — WO disclosed
WO-2010124230-A1 BONE FIXTURE ASSEMBLY UNIVERSITY OF MASSACHUSETTS (US) 2010-10-28 — — WO disclosed
EP-1061850-A4 SOLID-STATE MAGNETIC RESONANCE IMAGING SKELSCAN INC (US) 2005-06-15 — — EP disclosed
EP-1061850-A1 SOLID-STATE MAGNETIC RESONANCE IMAGING Skelscan Inc. (US) 2000-12-27 — — EP disclosed
WO-1999045842-A1 SOLID-STATE MAGNETIC RESONANCE IMAGING SKELSCAN, INC. (US) 1999-09-16 — — WO disclosed
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