SCHEMBL7757620

SCHEMBL7757620

Cc1c(OC(C)O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TYMP P19971 1/20 0.41
▸ HCAR2 Q8TDS4 2/20 0.33
▸ KDM4A O75164 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ HPGD P15428 1/20 0.32

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
SCHEMBL9354183 0.67 TYMP (0.42) TYMPALDH1A1
SCHEMBL4327340 0.65 TYMP (0.41) TYMP
SCHEMBL14341829 0.64 TYMP (0.39) TYMP
SCHEMBL16315851 0.64 TYMP (0.39) TYMPALDH1A1
SCHEMBL1445690 0.62 TYMP (0.56) TYMPALDH1A1
SCHEMBL4315836 0.61 TYMP (0.41) TYMPHCAR2
SCHEMBL31376425 0.60 TYMP (0.54) TYMPHCAR2
SCHEMBL12364192 0.59 L3MBTL1 (0.46) TYMPMAPTKDM4CALDH1A1
SCHEMBL2894307 0.58 JAK2 (0.57) TYMPMAPTALDH1A1HPGD
SCHEMBL5259684 0.58 TYMP (0.52) TYMP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0736015-B1 ANTIVIRAL 2,4-PYRIMIDINDIONE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF KOREA RES INST CHEM TECH (KR) 2001-03-07 — — EP disclosed
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