SCHEMBL28488292

SCHEMBL28488292

COC(=O)CC=C1CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 3/20 0.36
▸ LMNA P02545 2/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ TK2 O00142 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ BLM P54132 1/20 0.35
▸ PMP22 Q01453 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ ALOX12 P18054 1/20 0.34
▸ ADRA1A P35348 1/20 0.34
▸ ADRB1 P08588 1/20 0.34
▸ DNMT1 P26358 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
SCHEMBL28478745 0.85 TK1 (0.37) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL9708965 0.80 TK1 (0.40) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL28902082 0.78 LMNA (0.38) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL28492249 0.76 LMNA (0.38) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL5982761 0.76 TK1 (0.43) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL6026652 0.76 TK1 (0.43) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL8600466 0.76 TK1 (0.43) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL28494954 0.74 LMNA (0.36) TK1LMNASMN1; SMN2TK2CYP1A2
SCHEMBL28486921 0.74 LMNA (0.35) TK1LMNASMN1; SMN2CYP1A2CYP3A4
SCHEMBL7148871 0.71 TK1 (0.41) TK1LMNASMN1; SMN2TK2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107236011-B Nucleoside compound or salt thereof, nucleic acid and application thereof 中国人民解放军军事医学科学院毒物药物研究所 2020-11-27 — — CN disclosed
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