SCHEMBL29678282

SCHEMBL29678282

Sc1nc2ncccc2n1-c1ccc(C2CC2)c2ccccc12

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 19/20 0.60
CYP2C9 P11712 4/20 0.59
CYP2C19 P33261 3/20 0.59
CYP3A4 P08684 2/20 0.40
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
SLC22A11 Q9NSA0 1/20 0.38
PDK2 Q15119 1/20 0.36
SLC2A9 Q9NRM0 1/20 0.34

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
SCHEMBL21049171 1.00 SLC22A12 (0.60) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL25955290 0.81 SLC22A12 (0.72) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL21049189 0.81 SLC22A12 (0.45) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL25955294 0.80 SLC22A12 (0.79) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL19851018 0.80 SLC22A12 (0.67) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL19851105 0.80 SLC22A12 (0.67) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL19851009 0.80 SLC22A12 (0.79) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL19851015 0.77 SLC22A12 (0.66) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL25955010 0.77 SLC22A12 (0.82) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2
SCHEMBL31268399 0.77 SLC22A12 (0.64) SLC22A12CYP2C9CYP2C19CYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114685485-B Synthesis method of pyridoimidazole thiopropionic acid anti-gout compound 山东海雅医药科技有限公司 2024-03-26 CN disclosed
CN-115385907-B Room-temperature stable crystal form of pyridoimidazole thiopropionic acid anti-gout compound and preparation method thereof 山东海雅医药科技有限公司 2024-01-16 CN disclosed
CN-115322190-B Pyridoimidazole acyl sulfonamide derivative, and preparation method and application thereof 山东大学 2023-09-22 CN disclosed
CN-115385907-A Stable crystal form of pyridino-imidazole thiopropionic acid anti-gout compound at room temperature and preparation method thereof 山东海雅医药科技有限公司 2022-11-25 CN disclosed
CN-115322190-A Pyridoimidazole acylsulfonamide derivative and preparation method and application thereof 山东大学 2022-11-11 CN disclosed
CN-114685485-A Synthesis method of pyridylimidazole thiopropionic acid anti-gout compound 山东海雅医药科技有限公司 2022-07-01 CN disclosed