SCHEMBL24512490

SCHEMBL24512490

C=C1NC(=O)C=CN1[C@H]1C[C@@H](I)[C@@H](CO)O1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ TK1 P04183 2/20 0.34
▸ LMNA P02545 2/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.34
▸ ADRB1 P08588 1/20 0.32
▸ DNMT1 P26358 1/20 0.32
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ BLM P54132 1/20 0.31
▸ PMP22 Q01453 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ ALOX12 P18054 1/20 0.30
▸ ADRA1A P35348 1/20 0.30

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
SCHEMBL17732552 0.75 ALDH1A1 (0.39) LMNACYP1A2
SCHEMBL25458669 0.73 PYGM (0.44) LMNADNMT1BLMPMP22
SCHEMBL27064734 0.73 LMNA (0.43) TK1LMNASMN1; SMN2ADRB1DNMT1
SCHEMBL26311383 0.71 CDA (0.48) LMNASMN1; SMN2
SCHEMBL25712268 0.71 ALDH1A1 (0.31) LMNA
SCHEMBL18875014 0.70 ADORA2A (0.38) —
SCHEMBL14583693 0.70 ADORA2A (0.38) —
SCHEMBL15187536 0.70 ADORA2A (0.38) —
SCHEMBL16234376 0.69 TK1 (0.48) TK1LMNASMN1; SMN2ADRB1DNMT1
SCHEMBL19229350 0.69 CDA (0.39) —

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
WO-2022123501-A1 PROTECTED DEOXYDIDEHYDRO-NUCLEOSIDES VICTORIA LINK LIMITED (NZ) 2022-06-16 — — WO disclosed
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