SCHEMBL2867897

SCHEMBL2867897

O=P(O)(O)OP(=O)(O)OC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.44
FDPS P14324 2/20 0.38
BLM P54132 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPSR1 Q6W5P4 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
LMNA P02545 1/20 0.36
INPP5A Q14642 1/20 0.35
MVD P53602 2/20 0.34
GAA P10253 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
P2RY2 P41231 1/20 0.34
P2RY14 Q15391 1/20 0.34
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MMP2 P08253 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 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
Methane SCHEMBL8333618 0.98 ACHE (0.42) ACHEFDPSBLMTDP1NPSR1
Methane SCHEMBL8334400 0.98 ACHE (0.42) ACHEFDPSBLMTDP1NPSR1
Methane SCHEMBL10977969 0.98 ACHE (0.42) ACHEFDPSBLMTDP1NPSR1
Methane SCHEMBL8333035 0.98 ACHE (0.42) ACHEFDPSBLMTDP1NPSR1
Methane SCHEMBL10975254 0.98 ACHE (0.42) ACHEFDPSBLMTDP1NPSR1
SCHEMBL6252712 0.98 ACHE (0.41) ACHEFDPSBLMTDP1NPSR1
SCHEMBL25174140 0.96 ACHE (0.41) ACHEFDPSBLMTDP1NPSR1
Methane SCHEMBL8335521 0.96 ACHE (0.39) ACHEFDPSBLMTDP1NPSR1
Methane SCHEMBL8333017 0.91 FDPS (0.38) ACHEFDPSBLMTDP1NPSR1
SCHEMBL269924 0.91 ACHE (0.47) ACHEFDPSNPSR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7858661-B2 Protein refolding agent and refolding method SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-28 US disclosed
US-20100168403-A1 Protein refolding agent and refolding method YAMAGUCHI SHUNICHLRO 2010-07-01 US disclosed
US-20090111971-A1 PROTEIN REFOLDING AGENT AND REFOLDING METHOD SANYO CHEMICAL INDUSTRIES, LTD. (JP) 2009-04-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090111971-A1 PROTEIN REFOLDING AGENT AND REFOLDING METHOD HSPA5, HSPBP1, RRBP1 ACHE 1671/4885FDPS 532/4885BLM 3232/4885
US-20100168403-A1 Protein refolding agent and refolding method HSPA5, HSPBP1, RRBP1 ACHE 1709/4885FDPS 566/4885BLM 3143/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.