SCHEMBL28648951

SCHEMBL28648951

COC(=O)CCCCCOC1CCN(C(=O)O)C1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LSS P48449 1/20 0.38
GLA P06280 1/20 0.38
EPHX2 P34913 4/20 0.37
EPHX1 P07099 3/20 0.37
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
KMT2A Q03164 1/20 0.34
NAMPT P43490 1/20 0.34

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
SCHEMBL28648950 1.00 LSS (0.38) LSSGLAEPHX2EPHX1TSHR
SCHEMBL28566117 0.86 LSS (0.39) LSSSMN1; SMN2LMNAALDH1A1NAMPT
SCHEMBL28334816 0.85 LSS (0.37) LSSSMN1; SMN2LMNANAMPT
SCHEMBL28334814 0.85 LSS (0.37) LSSSMN1; SMN2LMNANAMPT
SCHEMBL29575514 0.84 PRMT5 (0.42) EPHX2EPHX1ALDH1A1KMT2A
SCHEMBL21767377 0.81 NAMPT (0.37) LSSNAMPT
SCHEMBL21767375 0.81 NAMPT (0.37) LSSNAMPT
SCHEMBL28559049 0.80 LMNA (0.35) LSSTSHRSMN1; SMN2LMNAALDH1A1
SCHEMBL18426120 0.78 KMT2A (0.42) KMT2A
SCHEMBL18426119 0.78 KMT2A (0.42) KMT2A

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
CN-113645977-A Compounds, compositions and methods for treatment of disease F-星治疗公司 2021-11-12 CN disclosed