SCHEMBL4023446

SCHEMBL4023446

C1CCCCCCCCC1.C1CCCCCCCCC1.CS(=O)(=O)OCC1(CO)CCCCCCCCC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
USP2 O75604 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MMP9 P14780 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
PRKCA P17252 1/20 0.32

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
SCHEMBL16028550 0.90 KDM4E (0.36) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL2591925 0.88 KDM4E (0.37) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL15538067 0.86 KDM4E (0.39) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL14671190 0.81 KDM4E (0.39) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL14391226 0.79 NPSR1 (0.37) USP2ALDH1A1LMNATSHR
SCHEMBL4023450 0.77 NPSR1 (0.34) USP2ALDH1A1LMNATSHR
SCHEMBL323068 0.77 USP2 (0.42) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL7863108 0.74 KMT2A (0.45) ALDH1A1LMNATSHR
SCHEMBL1672554 0.74 ALDH1A1 (0.36) KDM4EUSP2ALDH1A1LMNAMMP9
SCHEMBL18632473 0.73 CA2 (0.34)

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
WO-2009099436-A1 CURABLE COMPOSITIONS PREPARED FROM MULTIFUNCTIONAL AND HYBRID N-VINYLFORMAMIDE COMPOUNDS NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 2009-08-13 WO disclosed