SCHEMBL8543714

SCHEMBL8543714

O=C1CC(C(=O)O)NCN1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.47
GRIA2 P42262 1/20 0.42
CYP2D6 P10635 3/20 0.37
ALOX15 P16050 3/20 0.37
CYP1A2 P05177 3/20 0.37
LMNA P02545 2/20 0.37
BLM P54132 2/20 0.37
CYP2C19 P33261 2/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.37
THRB P10828 1/20 0.37
PMP22 Q01453 1/20 0.37
KMT2A Q03164 1/20 0.37
CAD P27708 2/20 0.35
SLC1A3 P43003 1/20 0.34
SLC1A2 P43004 1/20 0.34
SLC1A1 P43005 1/20 0.34
ITGB3 P05106 1/20 0.33
ITGB2 P05107 1/20 0.33

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
SCHEMBL6346374 1.00 EGLN1 (0.47) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL1300246 0.74
SCHEMBL690090 0.74
SCHEMBL690089 0.74
SCHEMBL4453517 0.72 CAD (0.42) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL6950284 0.72
SCHEMBL16467758 0.72 CAD (0.48) EGLN1GRIA2CYP2D6ALOX15CYP1A2
SCHEMBL190463 0.68
SCHEMBL635259 0.68
SCHEMBL7422071 0.68

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58110573-A None JP disclosed
CN-109678852-B 6-oxo-hexahydropyrimidine derivative, preparation method and pharmaceutical application thereof 南京中医药大学 2022-04-19 CN disclosed
CN-109678852-A 6- oxo hexahydropyrimidine derivative, preparation method and pharmacy application 南京中医药大学 2019-04-26 CN disclosed
EP-0442473-B1 Pyrimidinedione derivatives, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-08-19 EP disclosed
JP-S58110573-A HEXAHYDRO-6-OXO-4-PYRIMIDINECARBOXYLIC ACID DERIVATIVE OTSUKA PHARMACEUT FACTORY INC 1983-07-01 JP disclosed