SCHEMBL7377274

SCHEMBL7377274

CC1(C)O[C@@H]2[C@H](O1)[C@@H](CO)O[C@@H]2n1cnc(C(N)=O)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 5/20 0.63
▸ ALDH1A1 P00352 4/20 0.63
▸ SMN1; SMN2 Q16637 3/20 0.63
▸ ADORA1 P30542 2/20 0.63
▸ TSHR P16473 2/20 0.63
▸ THPO P40225 2/20 0.63
▸ PMP22 Q01453 2/20 0.63
▸ GLA P06280 1/20 0.63
▸ EIF4E P06730 1/20 0.63
▸ CYP3A4 P08684 1/20 0.63
▸ TOP1 P11387 1/20 0.63
▸ PI4KA P42356 1/20 0.49
▸ PI4K2B Q8TCG2 1/20 0.49
▸ PI4K2A Q9BTU6 1/20 0.49
▸ PI4KB Q9UBF8 1/20 0.49
▸ PNP P00491 3/20 0.48
▸ TDP1 Q9NUW8 2/20 0.45
▸ HTR2C P28335 1/20 0.41
▸ HTR2B P41595 1/20 0.41
▸ SLC6A3 Q01959 1/20 0.41

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
SCHEMBL12879149 1.00 LMNA (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL3762066 1.00 LMNA (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL12892430 1.00 LMNA (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL6839692 1.00 LMNA (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL13058163 1.00 LMNA (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL24024691 1.00 LMNA (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL12879146 0.91 LMNA (0.54) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL24024511 0.91 LMNA (0.54) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL13606971 0.88 PNP (0.63) LMNAALDH1A1SMN1; SMN2ADORA1TSHR
SCHEMBL6554011 0.86 LMNA (0.46) LMNAALDH1A1SMN1; SMN2ADORA1TSHR

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
US-4138547-A Process for preparing 1,2,4-triazole nucleosides ICN PHARMACEUTICALS, INC. (US) 1979-02-06 — — US disclosed
Send feedback