SCHEMBL11414877

SCHEMBL11414877

CC(=O)OCC(=O)[C@@]1(O)CC[C@H]2[C@@H]3CC(OC(C)=O)C4=CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 11/20 0.72
▸ PGR P06401 4/20 0.72
▸ AR P10275 3/20 0.72
▸ SERPINA6 P08185 2/20 0.72
▸ LMNA P02545 1/20 0.72
▸ CHRM1 P11229 1/20 0.72
▸ KMT2A Q03164 3/20 0.67
▸ CYP3A4 P08684 4/20 0.62
▸ TSHR P16473 3/20 0.62
▸ HSD17B10 Q99714 3/20 0.62
▸ CYP2C9 P11712 1/20 0.62
▸ ALDH1A1 P00352 1/20 0.62
▸ F2 P00734 1/20 0.59
▸ SMN1; SMN2 Q16637 3/20 0.58
▸ NFKB1 P19838 2/20 0.56
▸ PMP22 Q01453 1/20 0.56
▸ MAPT P10636 2/20 0.56
▸ POLB P06746 1/20 0.56
▸ GAA P10253 1/20 0.56
▸ NR3C1 P04150 3/20 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
SCHEMBL11414875 1.00 HIF1A (0.72) HIF1APGRARSERPINA6LMNA
SCHEMBL6566408 0.90 HIF1A (0.77) HIF1APGRARSERPINA6LMNA
SCHEMBL13152085 0.90 HIF1A (0.77) HIF1APGRARSERPINA6LMNA
SCHEMBL9267453 0.90 HIF1A (0.77) HIF1APGRARSERPINA6LMNA
SCHEMBL3404879 0.90 HIF1A (0.77) HIF1APGRARSERPINA6LMNA
SCHEMBL13103466 0.90 HIF1A (0.77) HIF1APGRARSERPINA6LMNA
SCHEMBL10625146 0.89 HIF1A (0.73) HIF1APGRARSERPINA6LMNA
SCHEMBL10599491 0.89 HIF1A (0.73) HIF1APGRARSERPINA6LMNA
Hydrocortisone Acetate SCHEMBL4940901 0.84 HIF1A (1.00) HIF1APGRARSERPINA6LMNA
Hydrocortisone Acetate SCHEMBL2679809 0.84 HIF1A (1.00) HIF1APGRARSERPINA6LMNA

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-4201778-A 6-Acyloxy-1,4,6-pregnatrienes, their use as anti-inflammatory agents, methods for their manufacture, and 6-oxo-1,4-pregnadiene intermediates SCHERING CORPORATION (US) 1980-05-06 — — US disclosed
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