SCHEMBL766565

SCHEMBL766565

O=C(O)N(CCO)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.58
ALDH1A1 P00352 2/20 0.55
HDAC3 O15379 1/20 0.55
HDAC4 P56524 1/20 0.55
HDAC1 Q13547 1/20 0.55
HDAC7 Q8WUI4 1/20 0.55
HDAC2 Q92769 1/20 0.55
HDAC10 Q969S8 1/20 0.55
HDAC11 Q96DB2 1/20 0.55
HDAC8 Q9BY41 1/20 0.55
HDAC6 Q9UBN7 1/20 0.55
HDAC9 Q9UKV0 1/20 0.55
HDAC5 Q9UQL6 1/20 0.55
LMNA P02545 2/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
LIMK2 P53671 1/20 0.52
NPSR1 Q6W5P4 1/20 0.52
REN P00797 2/20 0.51
GAA P10253 2/20 0.51

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
SCHEMBL268819 0.90 L3MBTL1 (0.50) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL4207867 0.88 HDAC1 (0.57) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL671194 0.86 REN (0.55) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL28741972 0.86 L3MBTL1 (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL27754647 0.86 L3MBTL1 (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL8615545 0.86 LIMK2 (0.63) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL678725 0.86 L3MBTL1 (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
Diphenylmethane SCHEMBL8928167 0.86 L3MBTL1 (0.49) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL4508037 0.85 LMNA (0.56) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1
SCHEMBL16333819 0.85 REN (0.54) L3MBTL1ALDH1A1HDAC3HDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1589029-B1 Pyrazinone protease inhibitors ORTHO MCNEIL PHARM INC (US) 2010-03-17 EP claimed
EP-3424939-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS Alnylam Pharmaceuticals Inc. (US) 2019-01-09 EP disclosed
US-20160348110-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS ALNYLAM PHARMACEUTICALS INC (US) 2016-12-01 US disclosed
US-9453043-B2 Nucleic acid chemical modifications ALNYLAM PHARMACEUTICALS, INC. (US) 2016-09-27 US disclosed
US-9181250-B2 Beta-lactamase inhibitor and process for preparing the same MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-11-10 US disclosed
US-20150210733-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS BANK OF AMERICA, N.A. 2015-07-30 US disclosed
US-20150141401-A1 NOVEL BETA-LACTAMASE INHIBITOR AND PROCESS FOR PREPARING THE SAME MEIJI SEIKA PHARMA CO., LTD. (JP) 2015-05-21 US disclosed
US-8975389-B2 Nucleic acid chemical modifications ALNYLAM PHARMACEUTICALS, INC. (US) 2015-03-10 US disclosed
EP-2669290-A1 Nucleic Acid Chemical Modifications Alnylam Pharmaceuticals Inc. (US) 2013-12-04 EP disclosed
EP-2403863-B1 NUCLEIC ACID CHEMICAL MODIFICATIONS ALNYLAM PHARMACEUTICALS INC (US) 2013-08-28 EP disclosed
WO-2004024082-A2 HIGHLY SPECIFIC MODULATORS OF GTPASES FOR TARGET VALIDATION IRM, LLC (GB) 2004-03-25 WO disclosed
US-6288141-B1 Ink compositions XEROX CORPORATION 2001-09-11 US disclosed
US-6187082-B1 COMPOSITION COMPRISED OF THIOUREA AND INK CARBAMATE, EACH WITH SPECIFIED MELTING POINT AND ACOUSTIC-LOSS VALUE, LIGHTFASTNESS COMPONENT, LIGHTFAST ANTIOXIDANT, COLORANT XEROX CORPORATION 2001-02-13 US disclosed
US-6045607-A FIRST AND SECOND SOLID CARBAMATES WITH A DISSIMILAR MELTING POINTS; LIGHTFASTNESS COMPONENT; A LIGHTFASTNESS ANTIOXIDANTS, AND A COLORANT; USEFUL FOR ACOUSTIC INK PRINTING XEROX CORPORATION (US) 2000-04-04 US disclosed
CN-1234023-A 4-aminoethoxy indoes as dopamin D2 agonists and as 5HT1A ligands AMERICAN HOME PROD (US) 1999-11-03 CN disclosed
CN-1234024-A 4-aminoethoxy indolone derivatives AMERICAN HOME PROD (US) 1999-11-03 CN disclosed
EP-0017772-B1 METHOD OF IMPROVING THE SOLUBILITY OF BIOLOGICALLY ACTIVE AGENTS IN WATER AND IN LOWER ALIPHATIC ALCOHOLS, AND COMPOUNDS HAVING AN IMPROVED SOLUBILITY BAYER AG (DE) 1982-07-28 EP disclosed
EP-0014263-B1 METHOD OF IMPROVING THE SOLUBILITY OF BIOLOGICALLY ACTIVE AGENTS IN WATER AND IN LOWER ALIPHATIC ALCOHOLS, AND COMPOUNDS HAVING AN IMPROVED SOLUBILITY BAYER AG (DE) 1982-05-05 EP disclosed
EP-0017772-A1 Method of improving the solubility of biologically active agents in water and in lower aliphatic alcohols, and compounds having an improved solubility BAYER AG (DE) 1980-10-29 EP disclosed
EP-0014263-A2 Method of improving the solubility of biologically active agents in water and in lower aliphatic alcohols, and compounds having an improved solubility BAYER AG (DE) 1980-08-20 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 (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-20150210733-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS NSUN2, RNMT, NSUN3 L3MBTL1 508/4885ALDH1A1 1390/4885HDAC3 3380/4885
US-20150141401-A1 NOVEL BETA-LACTAMASE INHIBITOR AND PROCESS FOR PREPARING THE SAME ME1, FN1, FNTB L3MBTL1 2363/4885ALDH1A1 466/4885HDAC3 589/4885

“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.