SCHEMBL6598781

SCHEMBL6598781

O=C(O)c1cc(Cl)ccc1-c1ccc(C=Cc2cc(C(F)(F)F)[nH]c(=O)n2)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 1.00
▸ KMT2A Q03164 7/20 1.00
▸ ALDH1A1 P00352 6/20 1.00
▸ KDM4E B2RXH2 6/20 1.00
▸ USP2 O75604 2/20 1.00
▸ L3MBTL1 Q9Y468 2/20 1.00
▸ CRHBP P24387 1/20 1.00
▸ CRHR2 Q13324 1/20 1.00
▸ POLB P06746 5/20 0.79
▸ HTT P42858 2/20 0.79
▸ RECQL P46063 2/20 0.79
▸ TLR9 Q9NR96 1/20 0.79
▸ PSD A5PKW4 1/20 0.67
▸ MAPT P10636 6/20 0.60
▸ LMNA P02545 3/20 0.60
▸ HPGD P15428 2/20 0.60
▸ TNF P01375 3/20 0.54
▸ NOD1 Q9Y239 3/20 0.54
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL6598777 1.00 MEN1 (1.00) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6594515 0.93 MEN1 (0.88) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6594511 0.93 MEN1 (0.88) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6597699 0.88 MEN1 (1.00) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6597698 0.88 MEN1 (1.00) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6594863 0.88 MEN1 (0.79) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6594860 0.88 MEN1 (0.79) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6594186 0.84 MEN1 (0.72) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6593384 0.84 KMT2A (0.72) MEN1KMT2AALDH1A1KDM4EUSP2
SCHEMBL6594182 0.84 MEN1 (0.72) MEN1KMT2AALDH1A1KDM4EUSP2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004016271-A1 PYRIMIDONES AS ANTIVIRAL AGENTS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-26 — — WO claimed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 — — EP claimed
WO-2004016271-A1 PYRIMIDONES AS ANTIVIRAL AGENTS AXXIMA PHARMACEUTICALS AG (DE) 2004-02-26 — — WO disclosed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 — — EP disclosed
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