SCHEMBL3952910

SCHEMBL3952910

CCCCCN(N)C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADH1A P07327 4/20 0.41
ADH1C P00326 3/20 0.40
ADH4 P08319 1/20 0.40
CYP1A2 P05177 1/20 0.40
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
ROCK2 O75116 1/20 0.35
ROCK1 Q13464 1/20 0.35
DNM1 Q05193 3/20 0.34
SIGMAR1 Q99720 2/20 0.34
NAAA Q02083 2/20 0.33
EPHX1 P07099 3/20 0.33

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
SCHEMBL7609404 0.98 ADH1A (0.43) ADH1AADH1CADH4CYP1A2THRA
SCHEMBL16949691 0.98 ADH1A (0.43) ADH1AADH1CADH4CYP1A2THRA
SCHEMBL9193281 0.98 ADH1A (0.43) ADH1AADH1CADH4CYP1A2THRA
SCHEMBL2347728 0.94 ADH1A (0.42) ADH1AADH1CADH4CYP1A2THRA
SCHEMBL460664 0.85 ADH1A (0.50) ADH1AADH1CCYP1A2ROCK2ROCK1
SCHEMBL16949669 0.82 ADH1A (0.48) ADH1AADH1CCYP1A2ROCK2ROCK1
SCHEMBL16334056 0.79 ADH1A (0.37) ADH1AADH1CADH4EPHX1
SCHEMBL14199743 0.78 THRA (0.47) ADH1AADH1CADH4CYP1A2THRA
SCHEMBL6062901 0.78 ADH1A (0.44) ADH1AADH1CADH4CYP1A2THRA
SCHEMBL9551192 0.78 ADH1A (0.44) ADH1AADH1CADH4CYP1A2THRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1807479-B1 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE MI LLC (US) 2012-08-22 EP claimed
US-7618925-B2 Shale hydration inhibition agent and method of use M-I L.L.C. (US) 2009-11-17 US claimed
US-20090175688-A1 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE M-I L.L.C. (US) 2009-07-09 US claimed
US-7521398-B2 A weighting agent selected from barite, calcite, hematite, iron oxide, calcium carbonate, organic and inorganic salts; and an antiswelling mixture of aminoalkylcyclohexylamines and aminoarylcyclohexlamines in fresh or sea water well bores; grinding and slurrying drill cuttings, injecting into formation M-I L.L.C. (US) 2009-04-21 US claimed
EP-1807479-A2 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE M-I L.L.C. (US) 2007-07-18 EP claimed
WO-2006041822-A2 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE M-I L.L.C. (US) 2006-04-20 WO claimed
US-20060073985-A1 Shale hydration inhibition agent and method of use M-I L.L.C. 2006-04-06 US claimed
US-20060073984-A1 Shale hydration inhibition agent and method of use M-I L.L.C. 2006-04-06 US claimed
US-20060073983-A1 Shale hydration inhibition agent and method of use M-I L.L.C. 2006-04-06 US claimed
EP-1807479-B1 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE MI LLC (US) 2012-08-22 EP disclosed
US-7618925-B2 Shale hydration inhibition agent and method of use M-I L.L.C. (US) 2009-11-17 US disclosed
US-20090175688-A1 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE M-I L.L.C. (US) 2009-07-09 US disclosed
US-7521398-B2 A weighting agent selected from barite, calcite, hematite, iron oxide, calcium carbonate, organic and inorganic salts; and an antiswelling mixture of aminoalkylcyclohexylamines and aminoarylcyclohexlamines in fresh or sea water well bores; grinding and slurrying drill cuttings, injecting into formation M-I L.L.C. (US) 2009-04-21 US disclosed
US-7514392-B2 Shale hydration inhibition agent and method of use M-I L.L.C. (US) 2009-04-07 US disclosed
US-7494958-B2 Shale hydration inhibition agent and method of use M-I L.L.C. (US) 2009-02-24 US disclosed
EP-1807479-A2 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE M-I L.L.C. (US) 2007-07-18 EP disclosed
WO-2006041822-A2 SHALE HYDRATION INHIBITION AGENT AND METHOD OF USE M-I L.L.C. (US) 2006-04-20 WO disclosed
US-20060073985-A1 Shale hydration inhibition agent and method of use M-I L.L.C. 2006-04-06 US disclosed
US-20060073984-A1 Shale hydration inhibition agent and method of use M-I L.L.C. 2006-04-06 US disclosed
US-20060073983-A1 Shale hydration inhibition agent and method of use M-I L.L.C. 2006-04-06 US disclosed