SCHEMBL23995932

SCHEMBL23995932

CC(C)(O)Oc1ccc(C(c2ccc(O)cc2)(C(F)(F)F)C(F)(F)F)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 7/20 0.62
▸ ESR2 Q92731 7/20 0.62
▸ MEN1 O00255 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ KDM4E B2RXH2 1/20 0.42
▸ CYP3A4 P08684 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TYR P14679 1/20 0.41
▸ AR P10275 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ SLC6A4 P31645 1/20 0.41
▸ HTR6 P50406 1/20 0.41
▸ ESRRG P62508 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ KIF11 P52732 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ HSD11B1 P28845 1/20 0.36

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
SCHEMBL7938037 0.84 ESR1 (0.69) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL21952955 0.83 ESR1 (0.53) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL7929177 0.81 ESR1 (0.64) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL7929343 0.80 ESR2 (0.69) ESR1ESR2KDM4EHSD11B1
SCHEMBL8999933 0.80 ESR1 (0.75) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL4560440 0.79 ESR1 (1.00) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL3686864 0.79 ESR1 (1.00) ESR1ESR2MEN1KMT2AKDM4E
SCHEMBL21027 0.79 ESR1 (1.00) ESR1ESR2MEN1KMT2AKDM4E
Bisphenol A SCHEMBL6878053 0.77 ESR1 (0.78) ESR1ESR2KDM4ECYP3A4LMNA
SCHEMBL24495838 0.77 ESR1 (0.46) ESR1ESR2HPGDSLC6A2SLC6A4

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-11167259-B2 Fluorinated carbonate derivative production method NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2021-11-09 — — 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-11167259-B2 Fluorinated carbonate derivative production method CA4, CA3, CA14 ESR1 1843/4885ESR2 2517/4885MEN1 289/4885

“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.

Send feedback