SCHEMBL22139362

SCHEMBL22139362

O=C1C=C(O)/C(=C2/C(=O)C(c3c(O)cc(O)c(C/C=C/c4ccccc4)c3O)=C2O)C(O)=C1C/C=C/c1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 3/20 0.34
▸ MAPT P10636 4/20 0.33
▸ HTT P42858 2/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ LMNA P02545 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ RECQL P46063 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ ALOX15 P16050 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
SCHEMBL22139358 0.80 XIAP (0.39) XIAPMAPTHTTMEN1KMT2A
SCHEMBL22139376 0.80 HSP90AA1 (0.30) —
SCHEMBL22139372 0.72 ALOX5 (0.34) XIAPMAPTMEN1KMT2AALDH1A1
SCHEMBL22139397 0.72 XIAP (0.41) XIAPMAPTHTTPKMALDH1A1
SCHEMBL22139361 0.69 XIAP (0.35) XIAP
SCHEMBL22139373 0.69 MAPK1 (0.43) XIAPMAPTHTTMEN1KMT2A
SCHEMBL9747012 0.63 MAPT (0.49) MAPTHTTMEN1KMT2ALMNA
SCHEMBL9747014 0.63 MAPT (0.49) MAPTHTTMEN1KMT2ALMNA
SCHEMBL14283805 0.61 ALOX5 (0.51) MAPTHTTMEN1KMT2ALMNA
SCHEMBL22139360 0.61 KDM4E (0.34) XIAPMAPTMEN1KMT2AALDH1A1

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-20200199058-A1 SQUARYLIUM COMPOUNDS FOR USE IN DISPLAY DEVICES NITTO DENKO CORPORATION (JP) 2020-06-25 — — 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-20200199058-A1 SQUARYLIUM COMPOUNDS FOR USE IN DISPLAY DEVICES SQLE, FDFT1, ALDH1A2 XIAP 930/4885MAPT 3928/4885HTT 4723/4885

“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.

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