SCHEMBL11042652

SCHEMBL11042652

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

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C2 P08235 8/20 0.66
▸ NR3C1 P04150 7/20 0.66
▸ PGR P06401 6/20 0.66
▸ HIF1A Q16665 5/20 0.66
▸ HSD17B10 Q99714 2/20 0.66
▸ CYP3A4 P08684 2/20 0.66
▸ ABCB11 O95342 2/20 0.66
▸ TNF P01375 1/20 0.66
▸ IL6 P05231 1/20 0.66
▸ SERPINA6 P08185 1/20 0.66
▸ AR P10275 1/20 0.66
▸ GLUL P15104 1/20 0.66
▸ ADAM17 P78536 1/20 0.66
▸ GPBAR1 Q8TDU6 1/20 0.66
▸ CYP2C19 P33261 1/20 0.66
▸ LMNA P02545 2/20 0.64
▸ USP2 O75604 1/20 0.64
▸ CYP2D6 P10635 1/20 0.64
▸ CYP2C9 P11712 1/20 0.64
▸ KMT2A Q03164 1/20 0.63

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
SCHEMBL11042626 1.00 NR3C2 (0.66) NR3C2NR3C1PGRHIF1AHSD17B10
SCHEMBL10945378 0.92 NR3C2 (0.68) NR3C2NR3C1PGRHIF1AHSD17B10
SCHEMBL6857093 0.92 NR3C2 (0.72) NR3C2NR3C1PGRHIF1AHSD17B10
SCHEMBL11016342 0.92 NR3C2 (0.72) NR3C2NR3C1PGRHIF1AHSD17B10
SCHEMBL6857090 0.92 NR3C2 (0.72) NR3C2NR3C1PGRHIF1AHSD17B10
SCHEMBL10945334 0.92 NR3C2 (0.68) NR3C2NR3C1PGRHIF1AHSD17B10
Prednival SCHEMBL11585728 0.91 HIF1A (0.73) NR3C2NR3C1PGRHIF1AHSD17B10
Prednival SCHEMBL25387 0.91 HIF1A (0.73) NR3C2NR3C1PGRHIF1AHSD17B10
Succinic Acid SCHEMBL22042712 0.91 NR3C1 (0.67) NR3C2NR3C1PGRHIF1AHSD17B10
SCHEMBL1945621 0.91 NR3C1 (0.67) NR3C2NR3C1PGRHIF1AHSD17B10

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-4435390-A Hydrocortisone derivatives, the preparation and use thereof SCHERING AKTIENGESELLSCHAFT (DE) 1984-03-06 — — US disclosed
Send feedback