SCHEMBL28285396

SCHEMBL28285396

CCCn1ccnc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.45
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.42
KMT2A Q03164 1/20 0.42
TLR8 Q9NR97 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
ESR1 P03372 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
PKM P14618 1/20 0.38
CYP2C19 P33261 1/20 0.38
KDM5A P29375 2/20 0.37
KDM5B Q9UGL1 2/20 0.37
PDE4A P27815 1/20 0.37
PDE1A P54750 1/20 0.37
PDE1B Q01064 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37

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
SCHEMBL5082397 0.89 ALDH1A1 (0.56) SMN1; SMN2ALDH1A1POLBKMT2ATLR8
SCHEMBL10448571 0.88 TLR8 (0.56) SMN1; SMN2ALDH1A1POLBKMT2ATLR8
SCHEMBL28441745 0.86 TLR8 (0.54) SMN1; SMN2ALDH1A1POLBKMT2ATLR8
SCHEMBL28285357 0.86 TLR8 (0.54) SMN1; SMN2ALDH1A1POLBKMT2ATLR8
Methane SCHEMBL28285372 0.86 TLR8 (0.54) SMN1; SMN2ALDH1A1POLBKMT2ATLR8
SCHEMBL300078 0.85 SMN1; SMN2 (0.47) SMN1; SMN2ALDH1A1POLBKMT2AESR1
SCHEMBL27845254 0.84 TLR8 (0.42) SMN1; SMN2ALDH1A1POLBKMT2ATLR8
SCHEMBL28420285 0.83 SMN1; SMN2 (0.42) SMN1; SMN2ESR1CYP2C19NPC1RAB9A
SCHEMBL28419045 0.81 SMN1; SMN2 (0.45) SMN1; SMN2ALDH1A1KMT2ATLR8ESR1
SCHEMBL28420218 0.81 SMN1; SMN2 (0.42) SMN1; SMN2ALDH1A1POLBESR1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118165639-B Wear-resistant lubricating oil coating material for mechanical bearing and preparation method thereof 西安大力马能源科技有限公司 2024-09-03 CN disclosed
CN-118165639-A Wear-resistant lubricating oil coating material for mechanical bearing and preparation method thereof 西安大力马能源科技有限公司 2024-06-11 CN disclosed
CN-111187218-B Application of 1-substituted-1H-imidazole-2-carboxylic acid compound in preparation of metal beta-lactamase inhibitor 四川大学 2023-08-04 CN disclosed
CN-111253317-B 1-substituted-1H-imidazole-2-carboxylic acid compound 四川大学 2023-08-04 CN disclosed
CN-111253317-A 1-substituted-1H-imidazole-2-carboxylic acid compound 四川大学 2020-06-09 CN disclosed
CN-111187218-A Application of 1-substituted-1H-imidazole-2-carboxylic acid compounds in preparation of metal β -lactamase inhibitor 四川大学 2020-05-22 CN disclosed
CN-109563050-A Amide salt compound, for the catalyst of polyurethane production and the production method of polyurethane resin 广荣化学工业株式会社 2019-04-02 CN disclosed