SCHEMBL20451346

SCHEMBL20451346

C[C@]12C=CC(=O)C=C1CCC1C2[C@@H](O)C[C@@]2(C)C1CC[C@]2(O)C(=O)COP(=O)(OCC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)C=C[C@]4(C)C3[C@@H](O)C[C@@]21C)OCC(=O)[C@@]1(O)CCC2C3CCC4=CC(=O)C=C[C@]4(C)C3[C@@H](O)C[C@@]21C

nearest known ligand 0.81

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PGR P06401 4/20 0.81
HIF1A Q16665 3/20 0.81
NR3C1 P04150 13/20 0.78
HSD17B10 Q99714 2/20 0.78
CYP3A4 P08684 2/20 0.78
AR P10275 2/20 0.78
ABCB11 O95342 1/20 0.78
TNF P01375 1/20 0.78
IL6 P05231 1/20 0.78
SERPINA6 P08185 1/20 0.78
NR3C2 P08235 1/20 0.78
GLUL P15104 1/20 0.78
ADAM17 P78536 1/20 0.78
GPBAR1 Q8TDU6 1/20 0.78
CYP2C19 P33261 1/20 0.78
LMNA P02545 1/20 0.72
KMT2A Q03164 1/20 0.60
F2 P00734 1/20 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
Prednisolone Phosphoric Acid SCHEMBL26490459 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL13130881 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
SCHEMBL3634790 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL7512 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL20451347 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL24622433 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL136773 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL21152533 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL21152848 0.95 PGR (0.78) PGRHIF1ANR3C1HSD17B10CYP3A4
Prednisolone Phosphoric Acid SCHEMBL23563 0.94 PGR (0.77) PGRHIF1ANR3C1HSD17B10CYP3A4

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-20180221406-A1 THERAPEUTIC COMBINATIONS OF ANTIVIRAL AND ANTI-INFLAMMATORY THERAPIES FORESIGHT BIOTHERAPEUTICS, INC. (US) 2018-08-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180221406-A1 THERAPEUTIC COMBINATIONS OF ANTIVIRAL AND ANTI-INFLAMMATORY THERAPIES EIF2AK2, IRF3, IFNG PGR 733/4885HIF1A 514/4885NR3C1 12/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.