SCHEMBL331086

SCHEMBL331086

Nc1nc(Cl)c(NC=O)c(N[C@H]2C=C[C@@H](CO)C2)n1

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.37
ALB P02768 1/20 0.37
PDE4D Q08499 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.32

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
SCHEMBL5117081 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL14048880 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL14049050 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL4980169 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL4980179 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL31454809 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL7668284 1.00 NR1I2 (0.37) NR1I2ALBPDE4DIRAK4
SCHEMBL9842434 0.83
SCHEMBL8446237 0.83
SCHEMBL8446236 0.83

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1982985-A2 Method for manufacturing a purine derivative Lonza AG (CH) 2008-10-22 EP claimed
EP-1657243-A1 Procedure for the production of amino alcohols Lonza AG (CH) 2006-05-17 EP claimed
US-20040142436-A1 Process for the preparation of aminoalcohol derivatives and their further conversion to (1R,4S)-4-(2-amino-6-chloro-5-formamido-4-pyrimidinyl)-amino)-2-cyclopentenyl-1-methanol BRIEDEN WALTER (CH) 2004-07-22 US claimed
US-6448402-B2 REDUCTION OF 2-AZABICYCLO(2.2.1)HEPT-5-EN-3-ONE USING METAL HYRIDE LONZA AG (CH) 2002-09-10 US claimed
US-20020010360-A1 Process for the preparation of aminoalcohol derivatives and their further conversion to (1R, 4S)-4-((2-amino-6-chloro-5-formamido-4-pyrimidinyl)-amino)-2-cyclopentenyl-1- methanol LONZA AG (CH) 2002-01-24 US claimed
EP-0926131-A2 Process for the preparation of aminoalcohol derivatives and their further transformation zu (1R,4S)-4-((2-amino-6-chlor-5-formamido-4-pyrimidinyl)-amino)-2-cyclopenten-1-methanol LONZA A.G. (CH) 1999-06-30 EP claimed
US-10385006-B2 Process for the preparation of amino alcohol derivatives or salts thereof GRANULES INDIA LIMITED (IN) 2019-08-20 US disclosed
US-20170233329-A1 PROCESS FOR THE PREPARATION OF AMINO ALCOHOL DERIVATIVES OR SALTS THEREOF GRANULES INDIA LTD (IN) 2017-08-17 US disclosed
US-8097723-B2 Process for the preparation of abacavir ESTEVE QUIMICA, S.A. (ES) 2012-01-17 US disclosed
US-8097723-B2 Process for the preparation of abacavir ESTEVE QUIMICA, S.A. (ES) 2012-01-17 US disclosed
US-8097723-B2 Process for the preparation of abacavir ESTEVE QUIMICA, S.A. (ES) 2012-01-17 US disclosed
EP-2125814-B1 PROCESS FOR THE PREPARATION OF ABACAVIR ESTEVE QUIMICA SA (ES) 2010-07-14 EP disclosed
US-20100041883-A1 Process for the preparation of abacavir Esteve Química, S.A. (ES) 2010-02-18 US disclosed
US-6087501-A Chloropyrimidine intermediates and processes for their preparation GLAXO WELLCOME INC. (US) 2000-07-11 US disclosed
EP-0741710-B1 CHLOROPYRIMIDINE INTERMEDIATES WELLCOME FOUND (GB) 2000-05-10 EP disclosed
EP-0926131-A2 Process for the preparation of aminoalcohol derivatives and their further transformation zu (1R,4S)-4-((2-amino-6-chlor-5-formamido-4-pyrimidinyl)-amino)-2-cyclopenten-1-methanol LONZA A.G. (CH) 1999-06-30 EP disclosed
US-5917042-A Process for the preparation of 2,5-diamino-4,6-dichloropyrimidine GLAXO WELLCOME INC. (US) 1999-06-29 US disclosed
US-5917041-A Chloropyrimidine intermediates GLAXO WELLCOME INC. (US) 1999-06-29 US disclosed
EP-0878548-A2 Multistep process for the preparation of (1S,4R)- and/or (1R,4S)-4-(2-Amino-6-Chlor-9-H-purin-9-yl)-2-cyclopentene-1-methanol LONZA AG (CH) 1998-11-18 EP disclosed
WO-1995021161-A1 CHLOROPYRIMIDE INTERMEDIATES THE WELLCOME FOUNDATION LIMITED (GB) 1995-08-10 WO 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 (4 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-20170233329-A1 PROCESS FOR THE PREPARATION OF AMINO ALCOHOL DERIVATIVES OR SALTS THEREOF ADH1C, ADH1A, ALDH7A1 NR1I2 2191/4885ALB 2819/4885PDE4D 1801/4885
US-20100041883-A1 Process for the preparation of abacavir CYP4A11, CYP4F11, CYP3A4 NR1I2 3021/4885ALB 3231/4885PDE4D 582/4885
US-20020010360-A1 Process for the preparation of aminoalcohol derivatives and their further conversion to (1R, 4S)-4-((2-amino-6-chloro-5-formamido-4-pyrimidinyl)-amino)-2-cyclopentenyl-1- methanol AASDHPPT, ALDH7A1, AADAT NR1I2 1490/4885ALB 2299/4885PDE4D 1001/4885
US-10385006-B2 Process for the preparation of amino alcohol derivatives or salts thereof ADH1C, ADH1A, ALDH7A1 NR1I2 2339/4885ALB 2605/4885PDE4D 1288/4885

“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.