SCHEMBL6597811

SCHEMBL6597811

O=c1nc(/C=C/c2ccc(-c3ccccc3F)o2)cc(C(F)(F)F)[nH]1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 0.74
▸ MEN1 O00255 7/20 0.74
▸ KMT2A Q03164 7/20 0.74
▸ ALDH1A1 P00352 7/20 0.74
▸ POLB P06746 5/20 0.74
▸ HTT P42858 3/20 0.74
▸ USP2 O75604 2/20 0.74
▸ RECQL P46063 2/20 0.74
▸ TLR9 Q9NR96 1/20 0.74
▸ MAPT P10636 7/20 0.70
▸ LMNA P02545 4/20 0.70
▸ HPGD P15428 3/20 0.70
▸ PSD A5PKW4 1/20 0.66
▸ CRHBP P24387 1/20 0.63
▸ CRHR2 Q13324 1/20 0.63
▸ L3MBTL1 Q9Y468 1/20 0.63
▸ TNF P01375 3/20 0.54
▸ NOD1 Q9Y239 3/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 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
SCHEMBL6597815 1.00 KDM4E (0.74) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6593636 0.89 ALDH1A1 (0.74) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6593639 0.89 ALDH1A1 (0.74) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6591499 0.88 KMT2A (0.73) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6591496 0.88 KMT2A (0.73) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6597698 0.85 MEN1 (1.00) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6597699 0.85 MEN1 (1.00) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6594684 0.85 KMT2A (0.68) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6594687 0.85 KMT2A (0.68) KDM4EMEN1KMT2AALDH1A1POLB
SCHEMBL6594328 0.84 PSD (0.68) KDM4EMEN1KMT2AALDH1A1POLB

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
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 — — EP claimed
EP-1389461-A1 Pyrimidones with antiviral properties Axxima Pharmaceuticals Aktiengesellschaft (DE) 2004-02-18 — — EP disclosed
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