SCHEMBL22844787

SCHEMBL22844787

C=CCN(C(=O)OCc1ccccc1)/C(C)=C/C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
HCAR2 Q8TDS4 1/20 0.44
MAPK1 P28482 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
SIGMAR1 Q99720 1/20 0.40
ABCB1 P08183 1/20 0.40
MAPT P10636 1/20 0.40
HPGD P15428 1/20 0.40
LMNA P02545 2/20 0.39
P2RX1 P51575 1/20 0.39
P2RX3 P56373 1/20 0.39
P2RX4 Q99571 1/20 0.39
TGM2 P21980 2/20 0.39
F13A1 P00488 1/20 0.39
TGM1 P22735 1/20 0.39
CCR6 P51684 1/20 0.39

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
SCHEMBL22618077 0.84 ALDH1A1 (0.53) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL3958174 0.82 HCAR2 (0.45) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL24677505 0.81 ALDH1A1 (0.49) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL3957711 0.80 ALDH1A1 (0.42) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL13684203 0.80 ALDH1A1 (0.50) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL541750 0.79 HCAR2 (0.51) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL8651697 0.78 HCAR2 (0.50) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL928852 0.78 ALDH1A1 (0.49) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL12493072 0.78 ALDH1A1 (0.49) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2
SCHEMBL7491138 0.78 HCAR2 (0.44) ALDH1A1HCAR2MAPK1L3MBTL1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11479549-B2 Nitrogen-containing cyclic compound and color conversion film comprising same LG CHEM, LTD. (KR) 2022-10-25 US disclosed
US-20200407352-A1 NITROGEN-CONTAINING CYCLIC COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME LG CHEM, LTD. (KR) 2020-12-31 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-11479549-B2 Nitrogen-containing cyclic compound and color conversion film comprising same CRY1, NUDC, BLVRB ALDH1A1 2509/4885HCAR2 4827/4885MAPK1 2269/4885
US-20200407352-A1 NITROGEN-CONTAINING CYCLIC COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME CRY1, NUDC, BLVRB ALDH1A1 2509/4885HCAR2 4827/4885MAPK1 2269/4885

“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.