SCHEMBL1064173

SCHEMBL1064173

CCCCCCCCCCCCCCCC[PH](CCC)(CCCC)CCCC

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.47
THRB P10828 1/20 0.47
DNM1 Q05193 7/20 0.36
ALDH1A1 P00352 3/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
HSD17B10 Q99714 1/20 0.36
SLC22A1 O15245 1/20 0.36
EPHX1 P07099 1/20 0.36

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
SCHEMBL1064301 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL1057338 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL1061078 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL3303123 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL3309655 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL3309565 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL1065998 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL4954370 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL1062564 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA
SCHEMBL3308656 1.00 TSHR (0.47) TSHRTHRBDNM1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7264653-B2 Methods for inhibiting hydrate blockage in oil and gas pipelines using simple quaternary ammonium and phosphonium compounds CHAMPION TECHNOLOGIES, INC. (US) 2007-09-04 US claimed
WO-2005042675-A2 METHODS FOR INHIBITING HYDRATE BLOCKAGE IN OIL AND GAS PIPELINES USING SIMPLE QUATERNARY AMMONIUM AND PHOSPHONIUM COMPOUNDS CHAMPION TECHNOLOGIES, INC. (US) 2005-05-12 WO claimed
US-20050081714-A1 Methods for inhibiting hydrate blockage in oil and gas pipelines using simple quaternary ammonium and phosphonium compounds HARBISON-FISCHER, INC. 2005-04-21 US claimed
EP-2272800-B1 Detoxification of water containing onium compounds BAKER HUGHES INC (US) 2015-01-21 EP disclosed
EP-2272800-A1 Detoxification of water containing onium compounds Baker Hughes Incorporated (US) 2011-01-12 EP disclosed
US-7381689-B2 Methods for inhibiting hydrate blockage in oil and gas pipelines using amide compounds CHAMPION TECHNOLOGIES, INC. (US) 2008-06-03 US disclosed
US-7264653-B2 Methods for inhibiting hydrate blockage in oil and gas pipelines using simple quaternary ammonium and phosphonium compounds CHAMPION TECHNOLOGIES, INC. (US) 2007-09-04 US disclosed
EP-1766183-A1 ENHANCEMENT MODIFIERS FOR GAS HYDRATE INHIBITORS Baker Hughes Incorporated (US) 2007-03-28 EP disclosed
WO-2005116399-A1 ENHANCEMENT MODIFIERS FOR GAS HYDRATE INHIBITORS BAKER HUGHES INCORPORATED (US) 2005-12-08 WO disclosed
US-20050261529-A1 Enhancement modifiers for gas hydrate inhibitors BAKER HUGHES INCORPORATED 2005-11-24 US disclosed
EP-1362160-B1 COMPOSITION AND METHOD FOR INHIBITION OF FORMATION OF GAS HYDRATES BAKER HUGHES INC (US) 2005-09-28 EP disclosed
EP-1362160-A1 COMPOSITION AND METHOD FOR INHIBITION OF FORMATION OF GAS HYDRATES BAKER HUGHES INCORPORATED (US) 2003-11-19 EP disclosed
US-6620330-B2 Removing pollutants from waste water streams BAKER HUGHES INCORPORATED 2003-09-16 US disclosed
US-20030146173-A1 Detoxification of quaternary onium compounds with polycarboxylate-containing compound BAKER HUGHES INCORPORATED 2003-08-07 US disclosed
US-6596911-B2 Providing a mixture comprising water and a hydrocarbon; and contacting with onium compound and amine salt for inhibiting the formation of the hydrocarbon hydrates BAKER HUGHES INCORPORATION 2003-07-22 US disclosed
WO-2003051781-A1 DETOXIFICATION OF QUATERNARY ONIUM COMPOUNDS WITH POLYCARBOXYLATE CONTAINING COMPOUND BAKER HUGHES INCORPORATED (US) 2003-06-26 WO disclosed
US-20030116507-A1 Detoxification of onium compounds BAKER HUGHES INCORPORATED 2003-06-26 US disclosed
WO-2003051776-A2 DETOXIFICATION OF WATER CONTAINING ONIUM COMPOUNDS BAKER HUGHES INCORPORATED (US) 2003-06-26 WO disclosed
WO-2002066785-A1 COMPOSITION AND METHOD FOR INHIBITION OF FORMATION OF GAS HYDRATES BAKER HUGHES INCORPORATED (US) 2002-08-29 WO disclosed
US-20020038063-A1 Composition and method for inhibition of formation of gas hydrates BAKER HUGHES INCORPORATED 2002-03-28 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 (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-20050261529-A1 Enhancement modifiers for gas hydrate inhibitors AQP1, API5, IWS1 TSHR 4386/4885THRB 4687/4885DNM1 1232/4885
US-20020038063-A1 Composition and method for inhibition of formation of gas hydrates HDHD5, SHH, NOTUM TSHR 3951/4885THRB 2764/4885DNM1 1836/4885

“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.