Hydrocortisone Butyrate

Hydrocortisone Butyrate

SCHEMBL11209085

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

NR3C1

The experimentally established mechanism targets of Hydrocortisone Butyrate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 known ✓ P04150 3/20 1.00
NR3C2 P08235 8/20 1.00
PGR P06401 4/20 1.00
HIF1A Q16665 8/20 0.92
KMT2A Q03164 2/20 0.92
AR P10275 3/20 0.71
CHRM1 P11229 2/20 0.71
SMN1; SMN2 Q16637 3/20 0.68
CYP2C19 P33261 2/20 0.68
HSD17B10 Q99714 2/20 0.68
MAPT P10636 2/20 0.68
SERPINA6 P08185 2/20 0.68
SHBG P04278 1/20 0.68
CYP3A4 P08684 1/20 0.68
NFKB1 P19838 1/20 0.68
POLB P06746 1/20 0.60
GAA P10253 1/20 0.60
LMNA P02545 2/20 0.58

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
Hydrocortisone Butyrate SCHEMBL4695 1.00 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL14339600 1.00 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL21111521 1.00 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL14473210 1.00 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL111478 1.00 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL14936050 1.00 NR3C2 (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Butyrate SCHEMBL8397588 0.98 NR3C2 (0.97) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Valerate SCHEMBL11356233 0.98 HIF1A (0.97) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Valerate SCHEMBL80603 0.96 HIF1A (1.00) NR3C2PGRNR3C1HIF1AKMT2A
Hydrocortisone Valerate SCHEMBL21111527 0.96 HIF1A (1.00) NR3C2PGRNR3C1HIF1AKMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0010056-B1 CORTICOID SULFOPROPIONIC ACID ESTERS AND THEIR SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL PREPARATIONS CONTAINING THESE COMPOUNDS SCHERING AKTIENGESELLSCHAFT (DE) 1983-08-24 EP disclosed
US-4296109-A ANTISHOCK, ANTIINFLAMMATORY SCHERING, AKTIENGESELLSCHAFT (DE) 1981-10-20 US disclosed
US-4049804-A Novel pregnanoic acid derivatives SCHERING AKTIENGESELLSCHAFT (DT) 1977-09-20 US disclosed
US-3944577-A Novel pregnane-21-oic acid derivatives SCHERING AKTIENGESELLSCHAFT (DT) 1976-03-16 US disclosed