SCHEMBL14775210

SCHEMBL14775210

CCOP(=O)(CN(C(C)CC)C(C)CC)OCC

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.44
MEN1 O00255 1/20 0.40
GAA P10253 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
KMT2A Q03164 1/20 0.40
PPARD Q03181 1/20 0.39
TDP1 Q9NUW8 2/20 0.35
TP53 P04637 1/20 0.34
ACHE P22303 1/20 0.31

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
SCHEMBL14775467 0.81 CYP3A4 (0.45) TSHRGAA
SCHEMBL35874 0.79 TSHR (0.44) TSHRMEN1GAACYP2C9CYP2C19
Monoethanolamine SCHEMBL18530680 0.71 PPARD (0.44) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL9442588 0.70 TSHR (0.55) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL5050661 0.69 MEN1 (0.63) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL19979585 0.69 MEN1 (0.63) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL8463197 0.68 GAA (0.45) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL14852884 0.67 PPARD (0.44) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL15241266 0.67 TSHR (0.50) TSHRMEN1GAACYP2C9CYP2C19
SCHEMBL9633264 0.66 TSHR (0.55) TSHRMEN1GAACYP2C9CYP2C19

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
US-11149226-B2 Preparation and use of aminoalkylphosphonic acid dialkyl ester compounds in a lubricant for antiwear, friction reduction, and/or micropitting prevention AFTON CHEMICAL CORPORATION (US) 2021-10-19 US disclosed
EP-2570471-B1 Aminoalkylphosphonic acid dialkyl ester compounds in a lubricant for antiwear and/or friction reduction AFTON CHEMICAL CORP (US) 2021-04-07 EP disclosed
US-20200181522-A1 Preparation and Use of Aminoalkylphosphonic Acid Dialkyl Ester Compounds in a Lubricant for Antiwear, Friction Reduction, and/or Micropitting Prevention AFTON CHEMICAL CORP (US) 2020-06-11 US disclosed
US-10563146-B2 Preparation and use of aminoalkylphosphonic acid dilakyl ester compounds in a lubricant for antiwear, friction reduction, and/or micropitting prevention AFTON CHEMICAL CORPORATION (US) 2020-02-18 US disclosed
US-20130072407-A1 PREPARATION AND USE OF AMINOALKYLPHOSPHONIC ACID DILAKYL ESTER COMPOUNDS IN A LUBRICANT FOR ANTIWEAR, FRICTION REDUCTION, AND/OR MICROPITTING PREVENTION AFTON CHEMICAL CORPORATION (US) 2013-03-21 US disclosed
EP-2570471-A1 Preparation and use of aminoalkylphosphonic acid dialkyl ester compounds in a lubricant for antiwear and/or friction reduction Afton Chemical Corporation (US) 2013-03-20 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 (3 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-20130072407-A1 PREPARATION AND USE OF AMINOALKYLPHOSPHONIC ACID DILAKYL ESTER COMPOUNDS IN A LUBRICANT FOR ANTIWEAR, FRICTION REDUCTION, AND/OR MICROPITTING PREVENTION TP53RK, MDK, DEK TSHR 3509/4885MEN1 4353/4885GAA 3860/4885
US-11149226-B2 Preparation and use of aminoalkylphosphonic acid dialkyl ester compounds in a lubricant for antiwear, friction reduction, and/or micropitting prevention TP53RK, PHOSPHO1, PTAFR TSHR 2938/4885MEN1 4516/4885GAA 4016/4885
US-20200181522-A1 Preparation and Use of Aminoalkylphosphonic Acid Dialkyl Ester Compounds in a Lubricant for Antiwear, Friction Reduction, and/or Micropitting Prevention TP53RK, PHOSPHO1, PTAFR TSHR 2938/4885MEN1 4516/4885GAA 4016/4885

“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.