SCHEMBL21435722

SCHEMBL21435722

c1ccc(-c2ccc(-c3c4ccccc4c(-c4ccc(-c5c6ccccc6c(-c6ccc(-c7ccccc7)cc6)c6ccccc56)cc4)c4ccccc34)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.56
ACHE P22303 2/20 0.52
MAPK1 P28482 2/20 0.48
MAPT P10636 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
TAAR1 Q96RJ0 2/20 0.48
CYP1A2 P05177 1/20 0.48
LMNA P02545 1/20 0.48
HTT P42858 1/20 0.48
CYP3A4 P08684 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MMP3 P08254 1/20 0.48
BCL2L1 Q07817 1/20 0.48
ESR1 P03372 5/20 0.46
ESR2 Q92731 5/20 0.46
KDM4E B2RXH2 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MGLL Q99685 1/20 0.42

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
SCHEMBL27919608 1.00 ALDH1A1 (0.56) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL21435740 1.00 ALDH1A1 (0.56) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL27367260 1.00 ALDH1A1 (0.56) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL5448953 0.97 ALDH1A1 (0.53) ALDH1A1ACHEMAPK1MAPTTDP1
Biphenyl SCHEMBL27941416 0.97 ALDH1A1 (0.60) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL30309416 0.97 ACHE (0.54) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL5572261 0.97 ACHE (0.54) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL29354925 0.94 ACHE (0.56) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL36757 0.94 ACHE (0.56) ALDH1A1ACHEMAPK1MAPTTDP1
SCHEMBL2960612 0.92 ALDH1A1 (0.47) ALDH1A1ACHEMAPK1MAPTTDP1

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-20190312207-A1 ORGANIC ELECTROLUMINESCENT ELEMENT KWANSEI GAKUIN EDUCATIONAL FOUNDATION (JP) 2019-10-10 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-20190312207-A1 ORGANIC ELECTROLUMINESCENT ELEMENT LEF1, NFE2L2, NFXL1 ALDH1A1 1474/4885ACHE 2332/4885MAPK1 1652/4885

“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.