SCHEMBL29336019

SCHEMBL29336019

CC(c1ccccc1)c1cc(C(C)c2ccccc2)c(OCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOS(C)(=O)=O)c(C(C)c2ccccc2)c1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
ALDH1A1 P00352 2/20 0.31
HTR2A P28223 2/20 0.31
HTR7 P34969 2/20 0.31
HTR1A P08908 1/20 0.31
ADRA1A P35348 1/20 0.31
HTR6 P50406 1/20 0.31
LMNA P02545 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
SCN8A Q9UQD0 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL14768630 0.89 ALDH1A1 (0.34) TYRL3MBTL1ALDH1A1LMNAGAA
SCHEMBL13392637 0.85 TYR (0.36) TYRALDH1A1LMNAGAAMAPT
SCHEMBL19760409 0.82 TYR (0.38) TYRL3MBTL1ALDH1A1HTR2AHTR7
SCHEMBL27396377 0.78 TYR (0.38) TYRALDH1A1MAPK1SCN8AMEN1
SCHEMBL21894643 0.78 ANPEP (0.36) TYRALDH1A1LMNAMEN1KMT2A
SCHEMBL14444135 0.77 TYR (0.39) TYRLMNAMAPTSCN8A
SCHEMBL15831118 0.76 THRB (0.40) TYRALDH1A1LMNAGAAMAPT
SCHEMBL1618270 0.76 ALDH1A1 (0.42) TYRALDH1A1GAAMAPK1SCN8A
SCHEMBL26277706 0.75 TDP1 (0.36) ALDH1A1LMNAGAAMAPTMAPK1
SCHEMBL14444133 0.75 PKM (0.41) TYRALDH1A1LMNAGAASCN8A

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-20240237649-A1 CRYSTALLINE FORMS OF 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4-DIHYDROPYRIMIDIN-2-ONE, AND MIXTURES, COMPOSITIONS AND METHODS OF USE THEREOF ADAMA MAKHTESHIM LTD. (IL) 2024-07-18 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-20240237649-A1 CRYSTALLINE FORMS OF 5-FLUORO-4-IMINO-3-METHYL-1-TOSYL-3,4-DIHYDROPYRIMIDIN-2-ONE, AND MIXTURES, COMPOSITIONS AND METHODS OF USE THEREOF NT5C, RCC1, INF2 TYR 709/4885L3MBTL1 3501/4885ALDH1A1 2485/4885

“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.