SCHEMBL6860646

SCHEMBL6860646

O=P(O)(O)Oc1cccc(C2C3CC4CC(C3)CC2C4)c1C1C2CC3CC(C2)CC1C3

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 6/20 0.44
INPP5A Q14642 4/20 0.44
INPP5B P32019 2/20 0.44
SRC P12931 5/20 0.36
KDM4E B2RXH2 1/20 0.36
USP2 O75604 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
PDE3A Q14432 1/20 0.36
HSD17B10 Q99714 1/20 0.36
AKT1 P31749 1/20 0.35
SCN9A Q15858 2/20 0.34
FBP1 P09467 1/20 0.34
SNCA P37840 1/20 0.31
PDK1 Q15118 1/20 0.31
HTR2A P28223 1/20 0.30

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
SCHEMBL7745693 0.72 CHRNB2 (0.42) ALDH1A1HPGDHSD17B10SCN9AHTR2A
SCHEMBL8558119 0.66 INPPL1 (0.47) INPPL1INPP5AINPP5BSRCKDM4E
SCHEMBL27199179 0.65 SCN9A (0.34) KDM4EALDH1A1HPGDHSD17B10SCN9A
SCHEMBL19249590 0.65 SCN9A (0.40) USP2SCN9A
SCHEMBL27554680 0.65 PTGDR2 (0.55) INPPL1INPP5AINPP5BSRCKDM4E
SCHEMBL10012213 0.65 SLC6A2 (0.32) SCN9A
SCHEMBL2573126 0.64 INPPL1 (0.70) INPPL1INPP5AINPP5BSRCKDM4E
SCHEMBL27520667 0.63 CHRNB2 (0.39) KDM4EALDH1A1HPGDHSD17B10SCN9A
SCHEMBL6474455 0.63 INPPL1 (0.41) INPPL1INPP5AINPP5BSRCKDM4E
SCHEMBL11769691 0.63 INPPL1 (0.47) INPPL1INPP5AINPP5BSRCKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794528-B2 HEAT RESISTANCE, FLAME RETARDERS, STABILIZERS; REACTING DIALCOHOL COMPOUND WITH A PHOSPHYL OXYCHLORIDE COMPOUND DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-21 US claimed
US-20030109736-A1 Phosphorus compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-06-12 US claimed
EP-1277758-A1 PHOSPHORUS COMPOUND Daicel Chemical Industries, Ltd. (JP) 2003-01-22 EP claimed
US-6794528-B2 HEAT RESISTANCE, FLAME RETARDERS, STABILIZERS; REACTING DIALCOHOL COMPOUND WITH A PHOSPHYL OXYCHLORIDE COMPOUND DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-21 US disclosed
US-20030109736-A1 Phosphorus compound DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2003-06-12 US disclosed
EP-1277758-A1 PHOSPHORUS COMPOUND Daicel Chemical Industries, Ltd. (JP) 2003-01-22 EP 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 (1 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-20030109736-A1 Phosphorus compound NR4A1, POLL, NR0B1 INPPL1 20/4885INPP5A 240/4885INPP5B 177/4885

“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.