SCHEMBL15470466

SCHEMBL15470466

CCN1C(=O)C=C(Nc2ccccc2O)C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 8/20 0.46
▸ MEN1 O00255 7/20 0.46
▸ KMT2A Q03164 7/20 0.46
▸ MAPT P10636 7/20 0.46
▸ HPGD P15428 6/20 0.46
▸ KDM4E B2RXH2 5/20 0.46
▸ HTT P42858 2/20 0.46
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ THRB P10828 2/20 0.46
▸ APAF1 O14727 1/20 0.46
▸ TDP2 O95551 1/20 0.46
▸ NSD2 O96028 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ CASP3 P42574 1/20 0.46
▸ BLM P54132 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ SENP8 Q96LD8 1/20 0.46
▸ SENP7 Q9BQF6 1/20 0.46
▸ SENP6 Q9GZR1 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.40

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
SCHEMBL13731660 0.72 MAPT (0.68) GAAMEN1KMT2AMAPTHPGD
SCHEMBL24430068 0.67 RGS4 (0.45) GAAMEN1KMT2AMAPTHPGD
SCHEMBL3443278 0.67 KMT2A (0.44) GAAKMT2AMAPTHPGDKDM4E
SCHEMBL24430071 0.66 RGS4 (0.44) GAAMEN1KMT2AMAPTHPGD
SCHEMBL1010796 0.66 ALDH1A1 (0.46) MEN1KMT2AMAPTHPGDKDM4E
SCHEMBL24430055 0.65 RGS4 (0.43) GAAMEN1KMT2AMAPTHPGD
SCHEMBL24429996 0.65 ALDH1A1 (0.44) GAAMEN1KMT2AMAPTHPGD
SCHEMBL7773988 0.65 GAA (0.50) GAAMEN1KMT2AMAPTKDM4E
SCHEMBL9326744 0.65 NPC1 (0.43) GAAMAPTKDM4ESMN1; SMN2ALDH1A1
SCHEMBL304891 0.64 CXCR2 (0.54) GAAMEN1KMT2AMAPTHPGD

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-20140045689-A1 3,4-disubstituted pyrrole 2,5-diones and their use as fungicides BASF SE (DE) 2014-02-13 — — US disclosed
US-20140045689-A1 3,4-disubstituted pyrrole 2,5-diones and their use as fungicides BASF SE (DE) 2014-02-13 — — 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-20140045689-A1 3,4-disubstituted pyrrole 2,5-diones and their use as fungicides CYP51A1, DDT, DPM1 GAA 1263/4885MEN1 1295/4885KMT2A 2683/4885

“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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