SCHEMBL7455484

SCHEMBL7455484

CCCCC(O)(CC)NC

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FDPS P14324 10/20 0.32
GGPS1 O95749 6/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL16105440 0.91 FDPS (0.42) FDPSGGPS1
Hydrochloric Acid SCHEMBL28287187 0.89 FDPS (0.41) FDPSGGPS1
SCHEMBL16105751 0.85 FDPS (0.32) FDPSGGPS1ESR1ESR2
SCHEMBL1199683 0.84
SCHEMBL28641343 0.78
SCHEMBL16105647 0.76 FDPS (0.42) FDPSGGPS1
SCHEMBL7566217 0.75 ALDH1A1 (0.39) FDPSGGPS1
SCHEMBL16105722 0.72
SCHEMBL28188873 0.70 FDPS (0.41) FDPSGGPS1
Hexane SCHEMBL28250564 0.69 TSHR (0.44) FDPSGGPS1

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
EP-2784059-B1 Method for isolating tertiary amino alcohol TOSHIBA KK (JP) 2016-08-24 EP disclosed
US-9181174-B2 Method for isolating tertiary amino alcohol KABUSHIKI KAISHA TOSHIBA (JP) 2015-11-10 US disclosed
US-20140296576-A1 METHOD FOR ISOLATING TERTIARY AMINO ALCOHOL KABUSHIKI KAISHA TOSHIBA (JP) 2014-10-02 US disclosed
EP-2784059-A1 Method for isolating tertiary amino alcohol Kabushiki Kaisha Toshiba (JP) 2014-10-01 EP disclosed
EP-0668271-B1 Process for the preparation of isocyanurate-group containing polyisocyanates BASF AG (DE) 2002-01-16 EP disclosed
US-5489663-A TRIMERIZING ALIPHATIC AND/OR CYCLOALIPHATIC DIISOCYANATES USING TETRAALKYLAMMONIUM ALKYL CARBONATE OR MIXTURES WITH QUATERNARY AMMONIOALKYL CARBONATE CATALYSTS, DEACTIVATING CATALYST BASF AKTIENGESELLSCHAFT (DE) 1996-02-06 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-20140296576-A1 METHOD FOR ISOLATING TERTIARY AMINO ALCOHOL ADH1C, AADAT, ADH1A FDPS 4709/4885GGPS1 4836/4885ESR1 2890/4885

“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.