SCHEMBL21133688

SCHEMBL21133688

CCCC(=O)NC1OC(COC(C)=O)C(OC(C)=O)C(OC(C)=O)C1NC(C)=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ POLB P06746 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ CA1 P00915 6/20 0.49
▸ CA2 P00918 6/20 0.49
▸ CA9 Q16790 6/20 0.49
▸ CA12 O43570 5/20 0.49
▸ PRKCA P17252 1/20 0.46
▸ AKT1 P31749 1/20 0.46
▸ PTK2 Q05397 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ NR3C1 P04150 1/20 0.44
▸ FYN P06241 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ ADRA2B P18089 1/20 0.44
▸ DRD4 P21917 1/20 0.44
▸ DRD3 P35462 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44

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
SCHEMBL16392573 0.87 CA1 (0.49) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL9524271 0.87 CA1 (0.49) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL9735191 0.87 CA1 (0.49) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL16392618 0.87 LMNA (0.50) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL16392904 0.87 LMNA (0.51) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL24997325 0.85 LMNA (0.48) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL22559700 0.84 LMNA (0.55) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL21138671 0.83 LMNA (0.65) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL21058368 0.83 LMNA (0.65) LMNAKMT2APOLBALDH1A1CA1
SCHEMBL21137853 0.83 LMNA (0.51) LMNAKMT2APOLBALDH1A1CA1

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-20190194655-A1 POLYNUCLEOTIDE CONSTRUCTS HAVING AN AUXILIARY MOIETY NON-BIOREVERSIBLY LINKED TO AN INTERNUCLEOSIDE PHOSPHATE OR PHOSPHOROTHIOATE BRADSHAW CURT W (US) 2019-06-27 — — US disclosed
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