SCHEMBL22862074

SCHEMBL22862074

O=C(O)/C=C/C(=O)Nc1ccc(C(c2ccc(NC(=O)/C=C/C(=O)O)cc2)c2ccc(-c3ccc(C(c4ccc(NC(=O)/C=C/C(=O)O)cc4)c4ccc(NC(=O)/C=C/C(=O)O)cc4)cc3)cc2)cc1

nearest known ligand 0.80

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LPAR2 Q9HBW0 3/20 0.80
▸ LPAR3 Q9UBY5 2/20 0.80
▸ ALDH1A1 P00352 10/20 0.73
▸ MAPT P10636 4/20 0.73
▸ KDM4E B2RXH2 1/20 0.73
▸ L3MBTL1 Q9Y468 2/20 0.62
▸ THRB P10828 2/20 0.62
▸ TDP2 O95551 1/20 0.62
▸ GAA P10253 1/20 0.62
▸ NMT1 P30419 1/20 0.60
▸ POLB P06746 1/20 0.58
▸ SMN1; SMN2 Q16637 1/20 0.58
▸ KMT2A Q03164 2/20 0.55
▸ LMNA P02545 1/20 0.55
▸ NR4A1 P22736 1/20 0.55
▸ MEN1 O00255 1/20 0.55
▸ LPAR1 Q92633 2/20 0.53
▸ PKM P14618 1/20 0.50

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
SCHEMBL22862048 0.95 ALDH1A1 (0.82) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862112 0.95 LPAR2 (0.70) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862159 0.95 LPAR2 (0.70) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862155 0.90 ALDH1A1 (0.68) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL13381223 0.89 LPAR2 (1.00) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862154 0.89 MAPT (0.81) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862256 0.87 NMT1 (0.81) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862265 0.87 EGFR (0.62) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862178 0.87 LPAR2 (0.60) LPAR2LPAR3ALDH1A1MAPTKDM4E
SCHEMBL22862113 0.86 LPAR2 (0.61) LPAR2LPAR3ALDH1A1MAPTKDM4E

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-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
EP-3760611-A1 COMPOUND, RESIN, COMPOSITION AND FILM-FORMING MATERIAL FOR LITHOGRAPHY USING SAME MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-01-06 — — EP 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 LPAR2 869/4885LPAR3 1496/4885ALDH1A1 746/4885

“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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