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Desmosterol

Desmosterol

SCHEMBL288290

CC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4CC(O)CC[C@]4(C)[C@H]3CC[C@]12C.CC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C.CC(C)=CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 3/20 1.00
▸ GRIN1 Q05586 6/20 0.77
▸ GRIN2A Q12879 6/20 0.77
▸ GRIN2B Q13224 5/20 0.77
▸ OSBP P22059 5/20 0.75
▸ OSBP2 Q969R2 2/20 0.75
▸ USP2 O75604 1/20 0.75
▸ LMNA P02545 1/20 0.75
▸ ABCB1 P08183 1/20 0.75
▸ CYP46A1 Q9Y6A2 1/20 0.75
▸ DHCR24 Q15392 1/20 0.74
▸ NR1H3 Q13133 7/20 0.74
▸ EPHA2 P29317 1/20 0.73
▸ NR1H2 P55055 1/20 0.72
▸ TSHR P16473 1/20 0.72
▸ TDP1 Q9NUW8 1/20 0.72

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
Desmosterol SCHEMBL26641636 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL12917612 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL156561 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL18942512 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL13833045 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL23565992 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL2154711 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL288400 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL288990 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP
Desmosterol SCHEMBL19507013 1.00 RORC (1.00) RORCGRIN1GRIN2AGRIN2BOSBP

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
EP-2427773-A1 METHOD OF DIAGNOSING ASPHYXIA Keller, Matthias (DE) 2012-03-14 — — EP disclosed
WO-2010128054-A1 METHOD OF DIAGNOSING ASPHYXIA BIOCRATES LIFE SCIENCES AG (AT) 2010-11-11 — — WO disclosed
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