SCHEMBL13447797

SCHEMBL13447797

CC(=O)NC1C(OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)C(COC(=O)c2ccccc2)O[C@H]1OCCCCC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ CYP3A4 P08684 1/20 0.49
▸ MAPT P10636 1/20 0.49
▸ CYP2C9 P11712 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ POLB P06746 3/20 0.47
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ USP2 O75604 1/20 0.43
▸ PTPN1 P18031 4/20 0.41
▸ KDM4E B2RXH2 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ GAPDH P04406 1/20 0.38
▸ PTPN2 P17706 1/20 0.37
▸ PTPN11 Q06124 1/20 0.37
▸ MMP12 P39900 1/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37

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
SCHEMBL24997212 1.00 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL15592313 1.00 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL17850335 1.00 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL14878523 0.94 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL13117380 0.94 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL12248448 0.94 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL15592304 0.93 LMNA (0.51) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL13447791 0.92 LMNA (0.51) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL16392954 0.91 LMNA (0.49) LMNAKMT2ACYP3A4MAPTCYP2C9
SCHEMBL23394602 0.91 LMNA (0.50) LMNAKMT2ACYP3A4MAPTCYP2C9

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-7674778-B2 Oligonucleotides comprising a conjugate group linked through a C5-modified pyrimidine ALNYLAM PHARMACEUTICALS (US) 2010-03-09 — — US disclosed
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