SCHEMBL7799154

SCHEMBL7799154

CCOC(=O)COc1ccc(Cn2c(-c3cccc(F)c3)c(C)c3cc(OCc4ccccc4)ccc32)cc1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 10/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
GPR34 Q9UPC5 2/20 0.45
ALOX5AP P20292 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
PLA2G2A P14555 1/20 0.44

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
SCHEMBL4167949 0.92 ESR1 (0.52) ESR1SMN1; SMN2MEN1KMT2APLA2G2A
SCHEMBL4155886 0.92 ESR1 (0.51) ESR1SMN1; SMN2MEN1KMT2A
SCHEMBL4151712 0.91 ESR1 (0.51) ESR1SMN1; SMN2MEN1KMT2A
SCHEMBL4165406 0.89 ESR1 (0.52) ESR1SMN1; SMN2MEN1KMT2A
SCHEMBL4144091 0.87 ESR1 (0.51) ESR1SMN1; SMN2ALOX5APMEN1KMT2A
SCHEMBL4152278 0.87 EDNRB (0.52) ESR1SMN1; SMN2MEN1KMT2APLA2G2A
SCHEMBL4146704 0.86 ESR1 (0.53) ESR1SMN1; SMN2MEN1KMT2A
SCHEMBL19949588 0.86 ESR1 (0.51) ESR1
SCHEMBL12939116 0.85 ESR1 (0.49) ESR1
SCHEMBL7837415 0.85 EDNRB (0.45) ESR1SMN1; SMN2ALOX5APMEN1KMT2A

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-20010021719-A1 2-phenyl-1- [4- (2-aminoethoxy) - benzyl] - indoles as estrogenic agents WYETH 2001-09-13 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-20010021719-A1 2-phenyl-1- [4- (2-aminoethoxy) - benzyl] - indoles as estrogenic agents ESR1, ESR2, GPER1 ESR1 1/4885SMN1; SMN2 4700/4885GPR34 199/4885

“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.