SCHEMBL11229008

SCHEMBL11229008

CCCC(=O)O[C@]1(C(O)=S)[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 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 9/20 0.76
▸ CYP3A4 P08684 4/20 0.76
▸ PGR P06401 4/20 0.76
▸ USP2 O75604 3/20 0.76
▸ MEN1 O00255 1/20 0.76
▸ KMT2A Q03164 1/20 0.76
▸ LMNA P02545 3/20 0.71
▸ MAPT P10636 3/20 0.71
▸ NR1I2 O75469 2/20 0.71
▸ SMN1; SMN2 Q16637 2/20 0.71
▸ NPSR1 Q6W5P4 2/20 0.71
▸ MLNR O43193 1/20 0.71
▸ ABCB11 O95342 1/20 0.71
▸ CYP3A5 P20815 1/20 0.71
▸ PPARG P37231 1/20 0.71
▸ CYP2D6 P10635 1/20 0.71
▸ CYP2C9 P11712 1/20 0.71
▸ ADORA3 P0DMS8 1/20 0.70
▸ DRD2 P14416 1/20 0.70
▸ OPRD1 P41143 1/20 0.70

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
SCHEMBL4215018 0.94 NR3C1 (0.81) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL4218692 0.94 NR3C1 (0.81) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11308113 0.92 NR3C1 (0.74) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11811655 0.92 NR3C1 (0.76) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11813420 0.92 NR3C1 (0.76) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11811664 0.92 NR3C1 (0.76) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11229005 0.91 NR3C1 (0.78) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11852753 0.91 NR3C1 (0.92) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11582313 0.91 NR3C1 (0.81) NR3C1CYP3A4PGRUSP2MEN1
SCHEMBL11852760 0.91 NR3C1 (0.92) NR3C1CYP3A4PGRUSP2MEN1

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-4335121-A TOPICAL ANTIINFLAMMATORY AGENTS GLAXO GROUP LIMITED (GB) 1982-06-15 — — US disclosed
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