SCHEMBL29049504

SCHEMBL29049504

O=C(O)c1cnc(-c2ncccn2)nc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAPRT Q6XQN6 3/20 0.43
KDM4E B2RXH2 5/20 0.41
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 3/20 0.41
L3MBTL1 Q9Y468 4/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
BLM P54132 1/20 0.40
AGER Q15109 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
HPGD P15428 3/20 0.40
LMNA P02545 3/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALOX12 P18054 1/20 0.38
KDM4A O75164 2/20 0.38
EGLN1 Q9GZT9 2/20 0.38

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
SCHEMBL30525578 1.00 NAPRT (0.43) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL30525582 0.82 KDM4E (0.47) KDM4ETDP1L3MBTL1MEN1KMT2A
SCHEMBL2558755 0.82 KDM4E (0.47) KDM4ETDP1L3MBTL1MEN1KMT2A
SCHEMBL3369832 0.80 KDM4E (0.50) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL3220634 0.80 HPGD (0.53) KDM4ETDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL3788527 0.80 MEN1 (0.60) TDP1ALDH1A1L3MBTL1MAPTMEN1
SCHEMBL30525576 0.80 P2RX7 (0.46) KDM4ETDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL29049458 0.80 P2RX7 (0.46) KDM4ETDP1ALDH1A1L3MBTL1CYP3A4
SCHEMBL11782992 0.77 MEN1 (0.50) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL11782258 0.77 MKNK1 (0.55) KDM4ETDP1ALDH1A1CYP3A4MAPT

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
CN-116514769-B 4-hydroxy pyrimidine-5-formylhydrazone derivative, preparation method, pharmaceutical composition and application 中国药科大学 2024-02-27 CN disclosed
CN-116514769-A 4-hydroxy pyrimidine-5-formylhydrazone derivative, preparation method, pharmaceutical composition and application 中国药科大学 2023-08-01 CN disclosed