SCHEMBL11586331

SCHEMBL11586331

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

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 11/20 0.66
▸ PGR P06401 8/20 0.66
▸ HIF1A Q16665 4/20 0.66
▸ LMNA P02545 4/20 0.66
▸ NR1I2 O75469 3/20 0.66
▸ CNR1 P21554 2/20 0.66
▸ CYP3A4 P08684 5/20 0.55
▸ USP2 O75604 4/20 0.55
▸ ABCB11 O95342 3/20 0.55
▸ CYP2C9 P11712 2/20 0.55
▸ MLNR O43193 1/20 0.55
▸ MAPT P10636 1/20 0.55
▸ CYP3A5 P20815 1/20 0.55
▸ PPARG P37231 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ HSD17B10 Q99714 2/20 0.55
▸ TNF P01375 1/20 0.55
▸ IL6 P05231 1/20 0.55

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
SCHEMBL11586335 1.00 NR3C1 (0.66) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11418175 0.92 NR3C1 (0.69) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11418169 0.92 NR3C1 (0.69) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11584989 0.91 PGR (0.68) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11230636 0.90 NR3C1 (0.65) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11586775 0.90 NR3C1 (0.63) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11586778 0.90 NR3C1 (0.63) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11581859 0.89 NR3C1 (0.60) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11580265 0.89 NR3C1 (0.60) NR3C1PGRHIF1ALMNANR1I2
SCHEMBL11229603 0.88 NR3C1 (0.63) NR3C1PGRHIF1ALMNANR1I2

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-4124707-A 7α-Halogeno-3,20-dioxo-1,4-pregnadienes, methods for their manufacture, their use as anti-inflammatory agents, and pharmaceutical formulations useful therefor SCHERING CORPORATION (US) 1978-11-07 — — US disclosed
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