SCHEMBL8600466

SCHEMBL8600466

C[C]1CN([C@H]2C[C@H](O)[C@@H](CO)O2)C(=O)NC1=O

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ TK2 O00142 1/20 0.43
▸ ALOX12 P18054 1/20 0.41
▸ ADRA1A P35348 1/20 0.41
▸ ADRB1 P08588 1/20 0.41
▸ DNMT1 P26358 1/20 0.41
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ TSHR P16473 1/20 0.40
▸ BLM P54132 1/20 0.40
▸ PMP22 Q01453 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40

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
SCHEMBL6026652 0.84 TK1 (0.43) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL5982761 0.84 TK1 (0.43) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL7148864 0.81 TK1 (0.41) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL7148871 0.81 TK1 (0.41) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL9708965 0.78 TK1 (0.40) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL28478745 0.78 TK1 (0.37) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL5613016 0.77 TK1 (0.43) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL5730127 0.77 TK1 (0.41) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL5964929 0.77 TK1 (0.41) TK1LMNASMN1; SMN2TK2ALOX12
SCHEMBL11678022 0.77 TK1 (0.44) TK1LMNASMN1; SMN2TK2ALOX12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5708161-A Nucleoside phosphorothioate derivatives, synthesis and use thereof KING'S COLLEGE LONDON (GB) 1998-01-13 — — US disclosed
EP-0577725-A4 TARGETED DRUG DELIVERY VIA MIXED PHOSPHATE DERIVATIVES UNIV FLORIDA (US) 1996-04-17 — — EP disclosed
EP-0577725-A1 TARGETED DRUG DELIVERY VIA MIXED PHOSPHATE DERIVATIVES UNIVERSITY OF FLORIDA (US) 1994-01-12 — — EP disclosed
WO-1992017185-A1 TARGETED DRUG DELIVERY VIA MIXED PHOSPHATE DERIVATIVES UNIVERSITY OF FLORIDA (US) 1992-10-15 — — WO disclosed
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