Clobetasol Propionate

Clobetasol Propionate

SCHEMBL11052078

CCC(=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@@]3(F)[C@@H](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 Clobetasol Propionate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 known ✓ P04150 6/20 1.00
PGR P06401 6/20 1.00
CYP3A4 P08684 5/20 1.00
USP2 O75604 5/20 1.00
LMNA P02545 3/20 1.00
MAPT P10636 3/20 1.00
NR1I2 O75469 2/20 1.00
SMN1; SMN2 Q16637 2/20 1.00
NPSR1 Q6W5P4 2/20 1.00
MLNR O43193 1/20 1.00
ABCB11 O95342 1/20 1.00
CYP3A5 P20815 1/20 1.00
PPARG P37231 1/20 1.00
CYP2D6 P10635 1/20 1.00
CYP2C9 P11712 1/20 1.00
ADORA3 P0DMS8 3/20 0.84
DRD2 P14416 1/20 0.84
OPRD1 P41143 1/20 0.84
MEN1 O00255 1/20 0.75
KMT2A Q03164 1/20 0.75

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
Clobetasol Propionate SCHEMBL5577907 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL17131797 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL3997 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL11052079 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL445257 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL5577908 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL10865006 1.00 PGR (1.00) PGRNR3C1CYP3A4USP2LMNA
Clobetasol Propionate SCHEMBL28118983 0.98 NR3C1 (0.95) PGRNR3C1CYP3A4USP2LMNA
Betamethasone Dipropionate SCHEMBL18301225 0.95 NR3C1 (0.93) PGRNR3C1CYP3A4USP2LMNA
SCHEMBL596943 0.94 NR3C1 (0.88) PGRNR3C1CYP3A4USP2LMNA

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
US-4427591-A TOPICAL ANTIINFLAMMATORY AGENTS THE UPJOHN COMPANY (US) 1984-01-24 US disclosed
US-4336200-A 17α-Acyloxy-5β-corticoids THE UPJOHN COMPANY (US) 1982-06-22 US disclosed
US-4318853-A ANTIINFLAMMATORY AGENTS THE UPJOHN COMPANY (US) 1982-03-09 US disclosed
US-4113680-A Method for preparing 17 α-ester-21-halo pregnanes TAISHO PHARMACEUTICAL CO., LTD. (JP) 1978-09-12 US disclosed