SCHEMBL22862108

SCHEMBL22862108

O=C(O)/C=C/C(=O)Nc1ccc2cc(C(c3ccc(-c4ccccc4)cc3)c3ccc4cc(NC(=O)/C=C/C(=O)O)ccc4c3)ccc2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.63
▸ MAPT P10636 6/20 0.63
▸ KDM4E B2RXH2 3/20 0.63
▸ LPAR2 Q9HBW0 3/20 0.56
▸ LPAR3 Q9UBY5 3/20 0.56
▸ THRB P10828 2/20 0.52
▸ PKM P14618 1/20 0.52
▸ LPAR1 Q92633 2/20 0.51
▸ KMT2A Q03164 4/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ TOP2A P11388 1/20 0.46
▸ TOP2B Q02880 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ CREBBP Q92793 1/20 0.45
▸ TDP2 O95551 1/20 0.44

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
SCHEMBL22862178 0.96 LPAR2 (0.60) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL22880042 0.93 ALDH1A1 (0.55) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL22862075 0.88 ALDH1A1 (0.56) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL22862048 0.88 ALDH1A1 (0.82) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL22862074 0.84 LPAR2 (0.80) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL22862155 0.81 ALDH1A1 (0.68) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL21515098 0.81 LPAR2 (0.67) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL11586886 0.81 LPAR2 (0.67) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL13381356 0.81 LPAR2 (0.67) ALDH1A1MAPTKDM4ELPAR2LPAR3
SCHEMBL22862113 0.80 LPAR2 (0.61) ALDH1A1MAPTKDM4ELPAR2LPAR3

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 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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