SCHEMBL22620145

SCHEMBL22620145

CCN(CC)c1ccc(N(C)c2ccc(N(C)c3ccc(N(CC)CC)cc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.61
L3MBTL1 Q9Y468 3/20 0.61
TSHR P16473 3/20 0.61
GFER P55789 2/20 0.61
MAPK1 P28482 2/20 0.61
CYP3A4 P08684 2/20 0.61
PSMD14 O00487 1/20 0.61
RECQL P46063 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
ALDH3A1 P30838 1/20 0.56
ALDH1A3 P47895 1/20 0.56
KDM4E B2RXH2 3/20 0.48
GAA P10253 3/20 0.48
CNR2 P34972 1/20 0.48
TERT O14746 1/20 0.46
MEN1 O00255 6/20 0.45
KMT2A Q03164 6/20 0.45
MAPT P10636 4/20 0.45
HPGD P15428 2/20 0.45
HSP90AA1 P07900 1/20 0.45

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
SCHEMBL1735497 0.88 ALDH1A1 (0.74) ALDH1A1L3MBTL1TSHRGFERMAPK1
Hydrochloric Acid SCHEMBL8046146 0.85 ALDH1A1 (0.70) ALDH1A1L3MBTL1TSHRGFERMAPK1
Hydrochloric Acid SCHEMBL8046149 0.85 ALDH1A1 (0.70) ALDH1A1L3MBTL1TSHRGFERMAPK1
SCHEMBL1874999 0.83 ALDH1A1 (0.61) ALDH1A1L3MBTL1TSHRGFERMAPK1
SCHEMBL332675 0.82 ALDH1A1 (0.67) ALDH1A1L3MBTL1TSHRGFERMAPK1
SCHEMBL1972710 0.82 ALDH1A1 (0.67) ALDH1A1L3MBTL1TSHRGFERMAPK1
SCHEMBL7153357 0.80 ALDH1A1 (0.64) ALDH1A1L3MBTL1TSHRGFERMAPK1
Formaldehyde SCHEMBL28197258 0.80 ALDH1A1 (0.65) ALDH1A1L3MBTL1TSHRGFERMAPK1
SCHEMBL11547210 0.80 ALDH1A1 (0.64) ALDH1A1L3MBTL1TSHRGFERMAPK1
SCHEMBL22620087 0.79 TSHR (0.78) ALDH1A1L3MBTL1TSHRMAPK1TDP1

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-11021436-B2 Compound, liquid composition, thermal transfer recording sheet, toner, resist composition for color filter, and color filter CANON KABUSHIKI KAISHA (JP) 2021-06-01 US disclosed
US-20200347007-A1 COMPOUND, LIQUID COMPOSITION, THERMAL TRANSFER RECORDING SHEET, TONER, RESIST COMPOSITION FOR COLOR FILTER, AND COLOR FILTER CANON KABUSHIKI KAISHA (JP) 2020-11-05 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-20200347007-A1 COMPOUND, LIQUID COMPOSITION, THERMAL TRANSFER RECORDING SHEET, TONER, RESIST COMPOSITION FOR COLOR FILTER, AND COLOR FILTER HNRNPR, TECR, TRRAP ALDH1A1 3007/4885L3MBTL1 3365/4885TSHR 146/4885
US-11021436-B2 Compound, liquid composition, thermal transfer recording sheet, toner, resist composition for color filter, and color filter HNRNPR, TECR, TRRAP ALDH1A1 3007/4885L3MBTL1 3365/4885TSHR 146/4885

“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.