SCHEMBL11655632

SCHEMBL11655632

O=C(O)Cc1ncn([C@@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H]2OC(=O)c2ccccc2)n1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.55
▸ USP2 O75604 1/20 0.55
▸ POLB P06746 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ CA1 P00915 4/20 0.52
▸ CA2 P00918 4/20 0.52
▸ CA9 Q16790 4/20 0.52
▸ GAPDH P04406 2/20 0.47
▸ HRAS P01112 1/20 0.45
▸ ALDH1A1 P00352 3/20 0.41
▸ P2RX3 P56373 1/20 0.41
▸ P2RX4 Q99571 1/20 0.41
▸ P2RX2 Q9UBL9 1/20 0.41
▸ HTT P42858 1/20 0.40
▸ CA12 O43570 3/20 0.39
▸ CA14 Q9ULX7 3/20 0.39
▸ PTPN1 P18031 2/20 0.39
▸ LMNA P02545 1/20 0.38
▸ LGALS9 O00182 1/20 0.35
▸ LGALS1 P09382 1/20 0.35

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
SCHEMBL7042701 0.83 MEN1 (0.59) MEN1USP2POLBKMT2ACA1
SCHEMBL14428974 0.82 MEN1 (0.52) MEN1USP2POLBKMT2ACA1
SCHEMBL29048523 0.81 LMNA (0.50) CA1CA2CA9ALDH1A1CA12
SCHEMBL5746383 0.77 MEN1 (0.54) MEN1USP2POLBKMT2ACA1
SCHEMBL7152660 0.77 MEN1 (0.60) MEN1USP2POLBKMT2ACA1
SCHEMBL1826966 0.76 POLB (0.60) MEN1USP2POLBKMT2ACA1
SCHEMBL1826964 0.76 POLB (0.60) MEN1USP2POLBKMT2ACA1
SCHEMBL6912407 0.75 LMNA (0.47) MEN1USP2POLBKMT2ACA1
SCHEMBL12300349 0.75 LMNA (0.47) MEN1USP2POLBKMT2ACA1
SCHEMBL10620690 0.75 MEN1 (0.54) MEN1USP2POLBKMT2ACA1

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-4082911-A PROCESS FOR THE PREPARATION OF NUCLEOSIDES SCHERING AKTIENGESELLSCHAFT (DT) 1978-04-04 — — US disclosed
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