SCHEMBL19632528

SCHEMBL19632528

CC(=O)O[C@]1(C=O)CCC2C3C=CC4=CC(=O)CC[C@]4(C)C3CC[C@@]21C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 5/20 0.58
CYP3A4 P08684 4/20 0.58
AR P10275 3/20 0.58
ALDH1A1 P00352 2/20 0.58
CYP2C19 P33261 2/20 0.58
CHRM1 P11229 2/20 0.58
TBXA2R P21731 2/20 0.58
ADRA1A P35348 2/20 0.58
CYP19A1 P11511 5/20 0.57
NR3C1 P04150 4/20 0.56
MEN1 O00255 4/20 0.56
KMT2A Q03164 4/20 0.56
CHRM2 P08172 2/20 0.56
OPRK1 P41145 1/20 0.56
TDP1 Q9NUW8 3/20 0.55
LMNA P02545 3/20 0.55
PDE4D Q08499 1/20 0.55
SMN1; SMN2 Q16637 3/20 0.49
CYP2C9 P11712 2/20 0.49
HIF1A Q16665 2/20 0.49

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
SCHEMBL6845447 0.85 CYP19A1 (0.62) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL6845448 0.85 CYP19A1 (0.62) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL149089 0.83 PGR (0.70) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL5925193 0.83 PGR (0.70) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL11594373 0.80 PGR (0.59) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL22152118 0.80 CYP19A1 (0.67) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL3934288 0.79 MEN1 (0.70) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL3934282 0.79 MEN1 (0.70) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL11648110 0.79 PGR (0.56) PGRCYP3A4ARALDH1A1CYP2C19
SCHEMBL3939910 0.78 PGR (0.67) PGRCYP3A4ARALDH1A1CYP2C19

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
US-20190153023-A1 Steroid 6.7.Beta.-Epoxides as Chemical Intermediates NZP UK Limited (GB) 2019-05-23 US disclosed
WO-2017199039-A1 STEROID 6.7.BETA.-EPOXIDES AS CHEMICAL INTERMEDIATES NZP UK Limited (GB) 2017-11-23 WO 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-20190153023-A1 Steroid 6.7.Beta.-Epoxides as Chemical Intermediates CYP7A1, CYP7B1, CYP21A2 PGR 216/4885CYP3A4 57/4885AR 158/4885

“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.