SCHEMBL4775369

SCHEMBL4775369

C=CCCN(CCC=C)CCC=C

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
ALDH1A1 P00352 2/20 0.35

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
SCHEMBL5570752 0.85 TSHR (0.35) TSHR
SCHEMBL24344912 0.85 TSHR (0.50) TSHRALDH1A1
SCHEMBL10581677 0.83 TSHR (0.33) TSHRALDH1A1
Hydrochloric Acid SCHEMBL22771702 0.83 TSHR (0.48) TSHRALDH1A1
Hydrochloric Acid SCHEMBL4665299 0.81 OPRK1 (0.33) TSHR
SCHEMBL571158 0.81
SCHEMBL5699187 0.81 TSHR (0.55) TSHRALDH1A1
Hydrochloric Acid SCHEMBL22771935 0.79 TSHR (0.52) TSHRALDH1A1
Hydrochloric Acid SCHEMBL22771599 0.78 MEN1 (0.48) TSHRALDH1A1
Hydrochloric Acid SCHEMBL22771971 0.77 TSHR (0.52) TSHRALDH1A1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080015121-A1 Compositions, methods and uses for sterically hindered quaternary ammonium compounds BAKER HUGHES INCORPORATED (US) 2008-01-17 US claimed
WO-2008008697-A2 COMPOSITIONS, METHODS AND USES FOR STERICALLY-HINDERED QUATERNARY AMMONIUM COMPOUNDS BAKER HUGHES INCORPORATED (US) 2008-01-17 WO claimed
EP-0138669-B1 PROCESS FOR THE PREPARATION OF SILANES FROM METHYLDICHLOROSILANE AND CHLOROSILANES RHONE-POULENC CHIMIE (FR) 1988-08-10 EP claimed
EP-0138670-B1 PROCESS FOR THE PREPARATION OF SILANES WITH A SI-H BOND BY REDISTRIBUTION RHONE-POULENC CHIMIE (FR) 1988-05-25 EP claimed
US-4746752-A QUATERNARY OR TERTIARY AMINE CATALYST RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1988-05-24 US claimed
US-4605543-A DISTRIBUTION AND DISPROPORTIONATION CATALYSIS RHONE-POULENC SPECIALITIES CHIMIQUES (FR) 1986-08-12 US claimed
EP-0138670-A2 Process for the preparation of silanes with a Si-H bond by redistribution RHONE-POULENC CHIMIE (FR) 1985-04-24 EP claimed
EP-0138669-A2 Process for the preparation of silanes from methyldichlorosilane and chlorosilanes RHONE-POULENC CHIMIE (FR) 1985-04-24 EP claimed
US-8535857-B2 Dye-containing negative curable composition, color filter, method of producing the same, and solid-state image sensor FUJIFILM CORPORATION (JP) 2013-09-17 US disclosed
US-8535857-B2 Dye-containing negative curable composition, color filter, method of producing the same, and solid-state image sensor FUJIFILM CORPORATION (JP) 2013-09-17 US disclosed
US-20090170015-A1 Dye-containing negative curable composition, color filter, method of producing the same, and solid-state image sensor FUJIFILM CORPORATION (JP) 2009-07-02 US disclosed
US-20090170015-A1 Dye-containing negative curable composition, color filter, method of producing the same, and solid-state image sensor FUJIFILM CORPORATION (JP) 2009-07-02 US disclosed
US-20080293597-A1 METHOD FOR INHIBITING HYDRATE FORMATION BAKER HUGHES INCORPORATED (US) 2008-11-27 US disclosed
WO-2008008697-A2 COMPOSITIONS, METHODS AND USES FOR STERICALLY-HINDERED QUATERNARY AMMONIUM COMPOUNDS BAKER HUGHES INCORPORATED (US) 2008-01-17 WO disclosed
EP-0138669-B1 PROCESS FOR THE PREPARATION OF SILANES FROM METHYLDICHLOROSILANE AND CHLOROSILANES RHONE-POULENC CHIMIE (FR) 1988-08-10 EP disclosed
EP-0138670-B1 PROCESS FOR THE PREPARATION OF SILANES WITH A SI-H BOND BY REDISTRIBUTION RHONE-POULENC CHIMIE (FR) 1988-05-25 EP disclosed
US-4746752-A QUATERNARY OR TERTIARY AMINE CATALYST RHONE-POULENC SPECIALITES CHIMIQUES (FR) 1988-05-24 US disclosed
US-4605543-A DISTRIBUTION AND DISPROPORTIONATION CATALYSIS RHONE-POULENC SPECIALITIES CHIMIQUES (FR) 1986-08-12 US disclosed
EP-0138670-A2 Process for the preparation of silanes with a Si-H bond by redistribution RHONE-POULENC CHIMIE (FR) 1985-04-24 EP disclosed
EP-0138669-A2 Process for the preparation of silanes from methyldichlorosilane and chlorosilanes RHONE-POULENC CHIMIE (FR) 1985-04-24 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 (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-20080015121-A1 Compositions, methods and uses for sterically hindered quaternary ammonium compounds HDHD5, DHX29, KAT7 TSHR 2613/4885ALDH1A1 3965/4885
US-20080293597-A1 METHOD FOR INHIBITING HYDRATE FORMATION HDHD5, DHX29, DHX9 TSHR 2607/4885ALDH1A1 3224/4885

“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.