SCHEMBL28896259

SCHEMBL28896259

CCOC(=O)c1[nH]ccc1NCc1ccc(Cl)c(CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ ALOX15 P16050 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 3/20 0.35
▸ NPSR1 Q6W5P4 2/20 0.35
▸ RECQL P46063 1/20 0.35
▸ MKNK2 Q9HBH9 1/20 0.34
▸ CYP4F2 P78329 1/20 0.34
▸ CYP4A11 Q02928 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ TDP1 Q9NUW8 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
SCHEMBL30028198 1.00 TSHR (0.43) TSHRSMN1; SMN2L3MBTL1ALOX15LMNA
SCHEMBL31603759 0.81 TSHR (0.35) TSHRSMN1; SMN2L3MBTL1ALOX15MAPT
SCHEMBL27413370 0.78 L3MBTL1 (0.43) L3MBTL1MAPTNPSR1RECQLKDM4E
SCHEMBL28896369 0.77 TSHR (0.39) TSHRSMN1; SMN2LMNAMAPTNPSR1
SCHEMBL28896249 0.77 SMN1; SMN2 (0.40) TSHRSMN1; SMN2ALOX15LMNATP53
SCHEMBL30601268 0.76 LMNA (0.53) ALOX15LMNATP53MAPTNPSR1
SCHEMBL30601264 0.76 LMNA (0.53) ALOX15LMNATP53MAPTNPSR1
SCHEMBL28896561 0.76 TSHR (0.40) TSHRSMN1; SMN2LMNATP53MAPT
SCHEMBL28896568 0.76 PDE5A (0.41) TSHRSMN1; SMN2LMNAMAPTNPSR1
SCHEMBL28896306 0.75 SMN1; SMN2 (0.39) TSHRSMN1; SMN2L3MBTL1ALOX15LMNA

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-115403584-B 2-thio-2, 3-dihydropyrimidine-4-one derivatives, pharmaceutical compositions, preparation methods and applications thereof 长春金赛药业有限责任公司 2024-04-02 — — CN disclosed
CN-115403584-A 2-thio-2, 3-dihydropyrimidine-4-one derivative, pharmaceutical composition, preparation method and application thereof 长春金赛药业有限责任公司 2022-11-29 — — CN disclosed
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