SCHEMBL6115183

SCHEMBL6115183

CCCCCC(C)[Si](O)(C(C)CCCCC)C(C)CCCCC

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.46
CA1 P00915 2/20 0.43
SPHK1 Q9NYA1 1/20 0.43
LMNA P02545 1/20 0.42
TP53 P04637 1/20 0.41
FDPS P14324 4/20 0.39
ACE2 Q9BYF1 1/20 0.39
GPR84 Q9NQS5 3/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL6114552 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114748 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114638 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114510 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114882 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114879 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114632 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6115138 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6114943 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS
SCHEMBL6115166 0.97 SPHK1 (0.46) OPRM1CA1SPHK1LMNAFDPS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2821395-A2 Novel disulfonic acid ester as an additive for an electrolyte for a lithium secondary battery Wako Pure Chemical Industries, Ltd. (JP) 2015-01-07 EP disclosed
US-8716513-B2 Process for production of bis-quaternary ammonium salt, and novel intermediate WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2014-05-06 US disclosed
EP-2463266-A1 PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE Wako Pure Chemical Industries, Ltd. (JP) 2012-06-13 EP disclosed
US-20120130107-A1 PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE WAKO PURE CHEMICAL INDUSTRIES, LTD. (JP) 2012-05-24 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 (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-20120130107-A1 PROCESS FOR PRODUCTION OF BIS-QUATERNARY AMMONIUM SALT, AND NOVEL INTERMEDIATE ASS1, C1S, FHIT OPRM1 2769/4885CA1 163/4885SPHK1 3824/4885

“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.