SCHEMBL10944869

SCHEMBL10944869

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

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 10/20 0.84
PGR P06401 3/20 0.84
SERPINA6 P08185 2/20 0.84
LMNA P02545 2/20 0.84
AR P10275 2/20 0.84
CHRM1 P11229 2/20 0.84
SMN1; SMN2 Q16637 3/20 0.83
CYP3A4 P08684 2/20 0.81
NFKB1 P19838 2/20 0.80
PMP22 Q01453 1/20 0.80
TSHR P16473 1/20 0.80
MAPT P10636 2/20 0.79
POLB P06746 1/20 0.79
GAA P10253 1/20 0.79
NR3C1 P04150 6/20 0.75
NR3C2 P08235 3/20 0.75
CYP2C19 P33261 2/20 0.75
HSD17B10 Q99714 2/20 0.75
SHBG P04278 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
SCHEMBL10940291 1.00 HIF1A (0.84) HIF1APGRSERPINA6LMNAAR
SCHEMBL16018308 0.94 HIF1A (0.93) HIF1APGRSERPINA6LMNAAR
SCHEMBL13368121 0.94 HIF1A (0.84) HIF1APGRSERPINA6LMNAAR
SCHEMBL4618329 0.94 HIF1A (0.84) HIF1APGRSERPINA6LMNAAR
SCHEMBL180225 0.93 HIF1A (0.84) HIF1APGRSERPINA6LMNAAR
SCHEMBL11234120 0.93 HIF1A (0.84) HIF1APGRSERPINA6LMNAAR
SCHEMBL10944893 0.92 HIF1A (0.85) HIF1APGRSERPINA6LMNAAR
SCHEMBL11043414 0.92 HIF1A (0.80) HIF1APGRSERPINA6LMNAAR
SCHEMBL11043424 0.92 HIF1A (0.80) HIF1APGRSERPINA6LMNAAR
SCHEMBL10944879 0.92 HIF1A (0.85) HIF1APGRSERPINA6LMNAAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0072546-B1 HYDROCORTISONE DERIVATIVES, THEIR PREPARATION AND THEIR UTILIZATION SCHERING AKTIENGESELLSCHAFT (DE) 1985-10-09 EP disclosed
US-4435390-A Hydrocortisone derivatives, the preparation and use thereof SCHERING AKTIENGESELLSCHAFT (DE) 1984-03-06 US disclosed