SCHEMBL22862075

SCHEMBL22862075

O=C(O)/C=C/C(=O)Nc1ccc(C(c2ccc(NC(=O)/C=C/C(=O)O)cc2)c2ccc3ccccc3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.56
▸ MAPT P10636 5/20 0.56
▸ KDM4E B2RXH2 1/20 0.56
▸ KMT2A Q03164 3/20 0.54
▸ MEN1 O00255 2/20 0.54
▸ LPAR2 Q9HBW0 3/20 0.53
▸ LPAR3 Q9UBY5 3/20 0.53
▸ L3MBTL1 Q9Y468 2/20 0.52
▸ POLB P06746 2/20 0.52
▸ SMN1; SMN2 Q16637 1/20 0.52
▸ LPAR1 Q92633 2/20 0.52
▸ THRB P10828 2/20 0.52
▸ PKM P14618 1/20 0.52
▸ TDP2 O95551 1/20 0.51
▸ GAA P10253 1/20 0.51
▸ NMT1 P30419 1/20 0.50
▸ EGFR P00533 1/20 0.49

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
SCHEMBL22862108 0.88 ALDH1A1 (0.63) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL22862155 0.87 ALDH1A1 (0.68) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL22862178 0.86 LPAR2 (0.60) ALDH1A1MAPTKDM4EKMT2ALPAR2
SCHEMBL22862113 0.86 LPAR2 (0.61) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL22862159 0.85 LPAR2 (0.70) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL22862112 0.85 LPAR2 (0.70) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL11586886 0.84 LPAR2 (0.67) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL13381356 0.84 LPAR2 (0.67) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL21515098 0.84 LPAR2 (0.67) ALDH1A1MAPTKDM4EKMT2AMEN1
SCHEMBL22862048 0.83 ALDH1A1 (0.82) ALDH1A1MAPTKDM4EKMT2AMEN1

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-20210003921-A1 COMPOUND, RESIN, COMPOSITION, AND FILM FORMING MATERIAL FOR LITHOGRAPHY USING THE SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-01-07 — — 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-20210003921-A1 COMPOUND, RESIN, COMPOSITION, AND FILM FORMING MATERIAL FOR LITHOGRAPHY USING THE SAME COL1A1, MLLT3, F12 ALDH1A1 746/4885MAPT 2695/4885KDM4E 348/4885

“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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