SCHEMBL23544787

SCHEMBL23544787

N#CCCCOCC1CO1

nearest known ligand 0.65

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.65
SMN1; SMN2 Q16637 1/20 0.57
ALDH1A1 P00352 4/20 0.53
TDP1 Q9NUW8 1/20 0.53
MAPK1 P28482 1/20 0.39
TP53 P04637 1/20 0.32
CYP3A4 P08684 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6860401 0.88
SCHEMBL15236365 0.82 LMNA (0.42) TSHRSMN1; SMN2ALDH1A1TDP1TP53
SCHEMBL15236544 0.80 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1TDP1
SCHEMBL100304 0.80 TSHR (0.90) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL13974192 0.80 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL21272 0.80 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL24547426 0.80 TSHR (0.90) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL17549551 0.80 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL17549553 0.80 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1
SCHEMBL17549552 0.80 TSHR (1.00) TSHRSMN1; SMN2ALDH1A1TDP1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023224095-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM 株式会社レゾナック 2023-11-23 WO disclosed
US-11639330-B2 Fluorine-containing ether compound, lubricant for magnetic recording medium, and magnetic recording medium SHOWA DENKO K.K. (JP) 2023-05-02 US disclosed
WO-2023276954-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM 昭和電工株式会社 2023-01-05 WO disclosed
US-20210188766-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM SHOWA DENKO K.K. (JP) 2021-06-24 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 (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-11639330-B2 Fluorine-containing ether compound, lubricant for magnetic recording medium, and magnetic recording medium AFF1, PHOSPHO1, CHRM1 TSHR 521/4885SMN1; SMN2 696/4885ALDH1A1 3194/4885
US-20210188766-A1 FLUORINE-CONTAINING ETHER COMPOUND, LUBRICANT FOR MAGNETIC RECORDING MEDIUM, AND MAGNETIC RECORDING MEDIUM AFF1, PHOSPHO1, CHRM1 TSHR 521/4885SMN1; SMN2 696/4885ALDH1A1 3194/4885

“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.