SCHEMBL144828

SCHEMBL144828

C=C(C)C(=O)OC(F)CCC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
ALDH1A1 P00352 2/20 0.35
THRB P10828 1/20 0.32

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
SCHEMBL28826230 0.93 TSHR (0.35) TSHRALDH1A1THRB
SCHEMBL28604438 0.89 TSHR (0.33) TSHRALDH1A1
SCHEMBL145573 0.83 TSHR (0.38) TSHRALDH1A1THRB
SCHEMBL2563105 0.81 ALDH1A1 (0.43) TSHRALDH1A1THRB
SCHEMBL15836502 0.79 TSHR (0.35) TSHRALDH1A1THRB
SCHEMBL21122757 0.79 TSHR (0.39) TSHRALDH1A1THRB
SCHEMBL15756037 0.78 TSHR (0.46) TSHRALDH1A1THRB
SCHEMBL15836505 0.77 ALDH1A1 (0.36) TSHRALDH1A1THRB
SCHEMBL13275506 0.76 TSHR (0.49) TSHRALDH1A1
SCHEMBL618450 0.76 TSHR (0.42) TSHRALDH1A1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115679692-A Fluorinated modified polylactic acid fiber membrane and preparation method and application thereof 江西服装学院 2023-02-03 CN claimed
CN-118667093-A Fluorocarbon modified ethoxy bisphenol A diacrylate, preparation method thereof, resin composition containing same and application of resin composition 爱迪特(秦皇岛)科技股份有限公司 2024-09-20 CN disclosed
CN-115679692-A Fluorinated modified polylactic acid fiber membrane and preparation method and application thereof 江西服装学院 2023-02-03 CN disclosed
US-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2012-03-08 US disclosed
US-20080004415-A1 Non-linear optically active molecules, their synthesis, and use OPTIMER PHOTONICS, INC. (US) 2008-01-03 US disclosed
EP-1742906-A2 NON-LINEAR OPTICALLY ACTIVE MOLECULES, THEIR SYNTHESIS, AND USE Optimer Photonics, Inc. (US) 2007-01-17 EP disclosed
WO-2005119315-A2 NON-LINEAR OPTICALLY ACTIVE MOLECULES, THEIR SYNTHESIS, AND USE OPTIMER PHOTONICS, INC. (US) 2005-12-15 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 (2 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-20120059163-A1 Non-linear opticaly active molecules, their synthesis, and use INCENP, CYBA, ADCY5 TSHR 4806/4885ALDH1A1 371/4885THRB 4746/4885
US-20080004415-A1 Non-linear optically active molecules, their synthesis, and use INCENP, CYBA, PAICS TSHR 4796/4885ALDH1A1 378/4885THRB 4823/4885

“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.