SCHEMBL28147488

SCHEMBL28147488

O=C(O)CCOP(=O)(O)C1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
ALDH1A1 P00352 1/20 0.37
PTGDR2 Q9Y5Y4 2/20 0.35
EPHX2 P34913 1/20 0.33
MMP2 P08253 5/20 0.33
CA12 O43570 3/20 0.33
CA1 P00915 3/20 0.33
CA2 P00918 3/20 0.33
CA9 Q16790 3/20 0.33
MMP1 P03956 3/20 0.33
MMP3 P08254 2/20 0.33
MMP8 P22894 2/20 0.33
MMP9 P14780 1/20 0.33
THRA P10827 2/20 0.31
THRB P10828 2/20 0.31
EPHX1 P07099 1/20 0.31

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
SCHEMBL777254 0.78 MMP1 (0.35) MMP2CA12CA1CA2CA9
SCHEMBL778639 0.76 METAP1 (0.43) MMP2CA12CA1CA2CA9
SCHEMBL28153502 0.76 LMNA (0.37) LMNAALDH1A1PTGDR2EPHX2MMP2
SCHEMBL777707 0.74 LPAR3 (0.52)
SCHEMBL778112 0.74 LPAR3 (0.40)
SCHEMBL5052981 0.73 FOLH1 (0.40) LMNAALDH1A1EPHX2
SCHEMBL9585304 0.73 MMP1 (0.44) ALDH1A1MMP2CA12CA1CA2
SCHEMBL3952299 0.72 ALDH1A1 (0.40) LMNAALDH1A1EPHX2MMP2CA12
SCHEMBL777568 0.72 SRC (0.42) LMNAMMP2CA12CA1CA2
SCHEMBL777334 0.72 SRC (0.42) LMNAMMP2CA12CA1CA2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105985514-B A kind of preparation method of flame-retardant polyester composition 东丽纤维研究所(中国)有限公司 2018-11-30 CN disclosed
CN-106700053-A Anti-dripping and flame-retardant fiber as well as production method and application thereof 东丽纤维研究所(中国)有限公司 2017-05-24 CN disclosed