SCHEMBL10956041

SCHEMBL10956041

CCCCCCCCCCCCCCCC(=O)N[C@@H]1[C@@H](OCc2ccccc2)O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O

nearest known ligand 0.65

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.65
▸ POLB P06746 2/20 0.60
▸ KMT2A Q03164 1/20 0.58
▸ SELP P16109 2/20 0.47
▸ TLR4 O00206 7/20 0.47
▸ TSHR P16473 1/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ MAPT P10636 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ LY96 Q9Y6Y9 2/20 0.44
▸ PRKCA P17252 1/20 0.44
▸ AKT1 P31749 1/20 0.44
▸ PTK2 Q05397 1/20 0.44
▸ TGM2 P21980 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
SCHEMBL10956036 1.00 LMNA (0.65) LMNAPOLBKMT2ASELPTLR4
SCHEMBL21058372 0.90 LMNA (0.65) LMNAPOLBKMT2ATSHRALDH1A1
SCHEMBL11014953 0.89 POLB (0.57) LMNAPOLBKMT2ASELPTSHR
SCHEMBL11014956 0.89 POLB (0.57) LMNAPOLBKMT2ASELPTSHR
SCHEMBL11080692 0.88 POLB (0.58) LMNAPOLBKMT2ASELPTSHR
SCHEMBL11080688 0.88 POLB (0.58) LMNAPOLBKMT2ASELPTSHR
SCHEMBL8931470 0.86 POLB (0.79) LMNAPOLBKMT2ATSHRALDH1A1
SCHEMBL21097453 0.86 POLB (0.79) LMNAPOLBKMT2ATSHRALDH1A1
SCHEMBL8931476 0.86 POLB (0.79) LMNAPOLBKMT2ATSHRALDH1A1
SCHEMBL20788116 0.85 LMNA (0.61) LMNAPOLBKMT2ATLR4ALDH1A1

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-4495346-A CATALYTICALLY COUPLING TWO MONOSACCHARIDES WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 1985-01-22 — — US disclosed
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