SCHEMBL23765855

SCHEMBL23765855

CCCCC1Cc2cc(OC(C)=O)ccc2C2CCC3(C)C(O)CCC3C12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 11/20 0.62
ESR2 Q92731 3/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
PGR P06401 2/20 0.62
LMNA P02545 2/20 0.62
ADORA3 P0DMS8 2/20 0.62
ATM Q13315 2/20 0.62
AR P10275 1/20 0.62
CHRM1 P11229 1/20 0.62
TBXA2R P21731 1/20 0.62
ADRA1A P35348 1/20 0.62
OPRM1 P35372 1/20 0.62
SLC6A3 Q01959 1/20 0.62
HDAC3 O15379 2/20 0.59
HDAC6 Q9UBN7 1/20 0.59
ESRRA P11474 6/20 0.52
CYP3A4 P08684 3/20 0.52
CYP2C19 P33261 2/20 0.52
NR3C1 P04150 2/20 0.52
NR1I2 O75469 1/20 0.52

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
SCHEMBL23765691 0.92 ESR1 (0.61) ESR1ESR2SMN1; SMN2PGRLMNA
SCHEMBL26462718 0.87 ESR1 (0.57) ESR1ESR2SMN1; SMN2PGRLMNA
SCHEMBL23765686 0.87 ESR1 (0.60) ESR1ESR2PGRLMNAHDAC3
SCHEMBL23424242 0.86 ESR1 (0.59) ESR1ESR2SMN1; SMN2PGRLMNA
SCHEMBL23424239 0.85 ESR1 (0.58) ESR1ESR2SMN1; SMN2PGRLMNA
SCHEMBL23765680 0.85 ESR1 (0.59) ESR1ESR2SMN1; SMN2PGRLMNA
SCHEMBL23424229 0.85 ESR1 (0.75) ESR1ESR2PGRLMNAHDAC3
SCHEMBL25629970 0.84 ESR1 (0.53) ESR1ESR2SMN1; SMN2PGRLMNA
SCHEMBL21077470 0.84 ESR1 (0.67) ESR1ESR2PGRHDAC3HDAC6
SCHEMBL26461990 0.83 ESR1 (0.54) ESR1ESR2SMN1; SMN2PGRLMNA

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-20210253626-A1 PRODRUGS OF FULVESTRANT KI PHARMACEUTICALS, LLC 2021-08-19 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-20210253626-A1 PRODRUGS OF FULVESTRANT CYP19A1, PGR, CYP21A2 ESR1 9/4885ESR2 13/4885SMN1; SMN2 4454/4885

“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.