SCHEMBL16474135

SCHEMBL16474135

CCC(=O)O[C@]1(C(=O)SCF)[C@H](C)CC2C3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](OC(C)=O)C[C@@]21C

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 14/20 0.81
PGR P06401 6/20 0.81
CYP3A4 P08684 6/20 0.81
AR P10275 4/20 0.81
ADORA3 P0DMS8 3/20 0.81
NR1I2 O75469 3/20 0.81
NR3C2 P08235 2/20 0.81
CHRM1 P11229 1/20 0.62
ADRA1A P35348 1/20 0.62
CNR1 P21554 1/20 0.62
PTGS1 P23219 1/20 0.62
HIF1A Q16665 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
ALDH1A1 P00352 1/20 0.55
CYP1A2 P05177 1/20 0.55
MEN1 O00255 1/20 0.55
ALOX15 P16050 1/20 0.55
KMT2A Q03164 1/20 0.55
LMNA P02545 2/20 0.48
USP2 O75604 2/20 0.48

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
Acetone SCHEMBL14645259 0.96 NR3C1 (0.81) NR3C1PGRCYP3A4ARADORA3
SCHEMBL4284 0.95 NR3C1 (0.83) NR3C1PGRCYP3A4ARADORA3
Alcohol SCHEMBL9363106 0.94 NR3C1 (0.81) NR3C1PGRCYP3A4ARADORA3
SCHEMBL16474137 0.93 NR3C1 (0.70) NR3C1PGRCYP3A4ARADORA3
SCHEMBL25130389 0.93 NR3C1 (0.83) NR3C1PGRCYP3A4ARADORA3
SCHEMBL2100405 0.92 NR3C1 (0.78) NR3C1PGRCYP3A4ARADORA3
SCHEMBL16479356 0.92 NR3C1 (0.78) NR3C1PGRCYP3A4ARADORA3
Fluticasone Propionate SCHEMBL1692230 0.92 NR3C1 (0.90) NR3C1PGRCYP3A4ARADORA3
SCHEMBL25130618 0.92 NR3C1 (0.82) NR3C1PGRCYP3A4ARADORA3
SCHEMBL13648003 0.92 NR3C1 (0.89) NR3C1PGRCYP3A4ARADORA3

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-20140200341-A1 Method for the Production of Fluoromethyl Esters of Androstan-17 beta Carboxylic Acids HOVIONE INTER LIMITED (CH) 2014-07-17 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-20140200341-A1 Method for the Production of Fluoromethyl Esters of Androstan-17 beta Carboxylic Acids HSD17B2, HSD17B7, CYP17A1 NR3C1 76/4885PGR 872/4885CYP3A4 126/4885

“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.