SCHEMBL5011891

SCHEMBL5011891

CCCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccc(OCC(=O)O)c(F)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.53
ESR2 Q92731 3/20 0.53
CYP19A1 P11511 2/20 0.47
PTGS2 P35354 2/20 0.46
THRA P10827 1/20 0.44
THRB P10828 1/20 0.44
HSD17B3 P37058 1/20 0.42
FFAR1 O14842 3/20 0.41
PPARD Q03181 3/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ESRRB O95718 1/20 0.40
PPARG P37231 1/20 0.40

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
SCHEMBL5007980 0.97 ESR1 (0.49) ESR1ESR2CYP19A1PTGS2THRA
SCHEMBL5010234 0.93 ESR1 (0.51) ESR1ESR2CYP19A1THRATHRB
SCHEMBL5007982 0.88 ESR1 (0.60) ESR1ESR2CYP19A1MEN1KMT2A
SCHEMBL5007263 0.86 KMT2A (0.57) ESR1ESR2CYP19A1PTGS2THRA
SCHEMBL5010212 0.86 ESR1 (0.50) ESR1ESR2CYP19A1PTGS2THRA
SCHEMBL3827799 0.81 ESR1 (0.70) ESR1ESR2CYP19A1PTGS2
SCHEMBL4665812 0.81 ESR1 (0.60) ESR1ESR2CYP19A1PTGS2PPARG
SCHEMBL13993292 0.79 MEN1 (0.60) ESR1ESR2CYP19A1MEN1KMT2A
SCHEMBL5007788 0.79 ESR1 (0.48) ESR1ESR2CYP19A1THRATHRB
SCHEMBL4674036 0.77 ESR1 (0.69) ESR1ESR2CYP19A1PTGS2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080319078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-12-25 US disclosed
US-20080319078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-12-25 US disclosed
US-20080319078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators KATAMREDDY SUBBA REDDY 2008-12-25 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-20080319078-A1 Triphenylethylene Compounds Useful as Selective Estrogen Receptor Modulators GPER1, ESR2, ESRRG ESR1 4/4885ESR2 2/4885CYP19A1 7/4885

“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.