SCHEMBL15844299

SCHEMBL15844299

CCCCCCC(C)(O)CF

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FDPS P14324 9/20 0.43
GGPS1 O95749 7/20 0.43
CES2 O00748 1/20 0.42
LPAR1 Q92633 1/20 0.42
LPAR3 Q9UBY5 1/20 0.42
SMPD1 P17405 1/20 0.39
TSHR P16473 1/20 0.38
THRB P10828 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
SCHEMBL28180755 0.98 FDPS (0.41) FDPSGGPS1CES2LPAR1LPAR3
SCHEMBL27548532 0.90
SCHEMBL5768532 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL8528159 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL5672619 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL4952756 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL5176670 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL11572196 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL2669436 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR
SCHEMBL2346921 0.85 FDPS (0.50) FDPSGGPS1CES2SMPD1TSHR

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
US-8916513-B2 Dioxirane compounds and uses thereof EMPIRE TECHNOLOGY DEVELOPMENT LLC (US) 2014-12-23 US disclosed
US-20140187467-A1 DIOXIRANE COMPOUNDS AND USES THEREOF CRESTLINE DIRECT FINANCE, L.P. 2014-07-03 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-20140187467-A1 DIOXIRANE COMPOUNDS AND USES THEREOF DUOX2, DECR2, SCO2 FDPS 2218/4885GGPS1 2382/4885CES2 682/4885

“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.