SCHEMBL23653624

SCHEMBL23653624

CCN(CC)c1ccc([C@H]2C[C@@]3(C)[C@@H](CC[C@]3(C)O)[C@@H]3CCC4=CC(=O)CC[C@@H]4[C@H]32)cc1

nearest known ligand 0.75

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 11/20 0.75
▸ NR3C1 P04150 10/20 0.75
▸ AR P10275 8/20 0.75
▸ CYP3A4 P08684 3/20 0.58
▸ LMNA P02545 2/20 0.43
▸ ABCB11 O95342 2/20 0.43
▸ TSHR P16473 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ SHBG P04278 1/20 0.43
▸ ADRA2A P08913 1/20 0.43
▸ SLC6A4 P31645 1/20 0.43

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
SCHEMBL20048417 0.87 NR3C1 (0.81) PGRNR3C1ARCYP3A4LMNA
SCHEMBL20048212 0.86 NR3C1 (1.00) PGRNR3C1ARCYP3A4
SCHEMBL30324808 0.86 NR3C1 (1.00) PGRNR3C1ARCYP3A4
SCHEMBL20048227 0.86 NR3C1 (1.00) PGRNR3C1ARCYP3A4
SCHEMBL20048415 0.85 NR3C1 (0.87) PGRNR3C1ARCYP3A4
SCHEMBL8541045 0.83 PGR (0.59) PGRNR3C1ARCYP3A4LMNA
SCHEMBL20048414 0.83 PGR (0.62) PGRNR3C1ARCYP3A4LMNA
SCHEMBL23645233 0.83 PGR (0.62) PGRNR3C1ARCYP3A4LMNA
SCHEMBL20048250 0.83 PGR (0.62) PGRNR3C1ARCYP3A4LMNA
SCHEMBL9019768 0.80 PGR (0.68) PGRNR3C1ARCYP3A4

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
EP-3851444-A1 INHIBITORS OF GLUCOCORTICOID RECEPTOR Oric Pharmaceuticals, Inc. (US) 2021-07-21 — — EP disclosed
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