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SCHEMBL10792533

SCHEMBL10792533

CC(C)C(=O)O[C@]1(C(=O)CO)[C@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C

nearest known ligand 0.81

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 18/20 0.81
▸ MMP1 P03956 17/20 0.81
▸ PGR P06401 4/20 0.78
▸ MEN1 O00255 1/20 0.78
▸ USP2 O75604 1/20 0.78
▸ CYP3A4 P08684 1/20 0.78
▸ KMT2A Q03164 1/20 0.78

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
SCHEMBL11882871 1.00 NR3C1 (0.81) NR3C1MMP1PGRMEN1USP2
SCHEMBL11882866 1.00 NR3C1 (0.81) NR3C1MMP1PGRMEN1USP2
SCHEMBL8194630 0.94 NR3C1 (0.79) NR3C1MMP1PGRMEN1USP2
SCHEMBL11581526 0.93 NR3C1 (0.81) NR3C1MMP1PGRMEN1USP2
SCHEMBL11581521 0.93 NR3C1 (0.81) NR3C1MMP1PGRMEN1USP2
SCHEMBL11016968 0.92 NR3C1 (0.82) NR3C1MMP1PGRMEN1USP2
SCHEMBL11812693 0.92 NR3C1 (0.83) NR3C1MMP1PGRMEN1USP2
SCHEMBL7547 0.92 NR3C1 (0.83) NR3C1MMP1PGRMEN1USP2
SCHEMBL6986508 0.92 NR3C1 (0.83) NR3C1MMP1PGRMEN1USP2
Betamethasone Acibutate SCHEMBL10792711 0.91 NR3C1 (0.75) NR3C1MMP1PGRMEN1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4655971-A USING AN ANHYDRIDE AND ACID CATALYST TO ESTERIFY HYDROXY'S IN THE 17- OR 17- AND 21-POSITION; ENHANCED ANTIINFLAMMATORY AGENTS PLURICHEMIE ANSTALT (LI) 1987-04-07 — — US disclosed
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