SCHEMBL30345442

SCHEMBL30345442

O=C(O)CNC(=O)c1cnc(NC(=O)c2ccc(Cl)cc2)nc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGLN1 Q9GZT9 4/20 0.47
▸ KDM4E B2RXH2 3/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ EGLN3 Q9H6Z9 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ ADORA3 P0DMS8 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ SLC22A6 Q4U2R8 1/20 0.43
▸ SLC22A8 Q8TCC7 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ RXFP1 Q9HBX9 1/20 0.42
▸ P4HTM Q9NXG6 1/20 0.41
▸ DEGS1 O15121 1/20 0.41
▸ KMT2A Q03164 2/20 0.41

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
SCHEMBL28452694 1.00 EGLN1 (0.47) EGLN1KDM4ECYP1A2CYP3A4CYP2D6
SCHEMBL28441539 0.87 DGAT1 (0.49) EGLN1EGLN3DEGS1KMT2ANPC1
SCHEMBL28445193 0.85 KDM4E (0.48) EGLN1KDM4ECYP1A2LMNAMAPT
SCHEMBL30345425 0.85 KDM4E (0.48) EGLN1KDM4ECYP1A2LMNAMAPT
SCHEMBL28442664 0.84 EGLN1 (0.50) EGLN1KMT2ANPC1RAB9AKCNQ3
SCHEMBL30345507 0.84 EGLN1 (0.50) EGLN1KMT2ANPC1RAB9AKCNQ3
SCHEMBL28448361 0.83 HDAC3 (0.50) EGLN1EGLN3LMNA
SCHEMBL30345395 0.83 HDAC3 (0.50) EGLN1EGLN3LMNA
SCHEMBL28442587 0.81 EGLN1 (0.64) EGLN1KDM4EEGLN3MAPTKMT2A
SCHEMBL30345459 0.81 EGLN1 (0.64) EGLN1KDM4EEGLN3MAPTKMT2A

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-111559982-B 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2023-04-07 — — CN claimed
CN-111559982-B 2- (2-substituted-4-hydroxypyrimidine-5-formamido) acetic acid compound and preparation method and application thereof 天津市医药科学研究所 2023-04-07 — — CN disclosed
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