SCHEMBL19901393

SCHEMBL19901393

CC(C)CCCC(C)CCC(C)CCC(C)(C)CCCCC(C)CCC(C)C

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.56
MEN1 O00255 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
KMT2A Q03164 1/20 0.46
BLM P54132 1/20 0.38
PTPN1 P18031 2/20 0.36
PTPN2 P17706 1/20 0.36
CDC25B P30305 1/20 0.36

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
SCHEMBL8425014 0.80 MEN1 (0.50) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL25057512 0.78 MEN1 (0.56) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL18584315 0.78 LMNA (0.81) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL23349147 0.76 LMNA (0.62) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL11759786 0.76 MEN1 (0.50) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL20978400 0.75 LMNA (0.45) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL11700396 0.75 LMNA (0.61) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL13061540 0.75 LMNA (0.54) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL306062 0.75 LMNA (0.48) LMNAMEN1CYP3A4ALOX15KMT2A
SCHEMBL2985725 0.75 LMNA (1.00) LMNAMEN1CYP3A4ALOX15KMT2A

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-9902985-B2 Chemoenzymatic methods for synthesizing moenomycin analogs PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2018-02-27 US disclosed