SCHEMBL4980179

SCHEMBL4980179

Nc1nc(Cl)c(NC=O)c(N[C@@H]2C=CC(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
SCHEMBL331086 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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11228510-A None JP disclosed
US-7358073-B2 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) 2008-04-15 US disclosed
US-7338945-B2 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) 2008-03-04 US disclosed
US-7338945-B2 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) 2008-03-04 US disclosed
CN-1323057-C Process for the preparation of (1S,4R) or (1R,4S)-1-amino-4-(methylol)-2-cyclopentene and its derivatives or its salts LONZA AG (CH) 2007-06-27 CN disclosed
US-20070123545-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 LTD. (CH) 2007-05-31 US disclosed
US-20070123545-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 LTD. (CH) 2007-05-31 US disclosed
CN-1277807-C Process for the preparation of aminoalcohol and (1S,4R)or (1R,4S)-1-amino-4-(methylol)-2-cyclopentene or its salts LONZA AG (CH) 2006-10-04 CN disclosed
US-20060211862-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 INC. (US) 2006-09-21 US disclosed
US-20060211862-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 INC. (US) 2006-09-21 US disclosed
US-6723868-B1 REDUCING 2-AZABICYCLO(2.2.1)HEPT-5-EN-1-ONE WITH LITHIUM BOROHYDRIDE TO FORM 1-AMINO-4-(HYDROXYMETHYL)-2- CYCLOPENTENE LONZA AG (CH) 2004-04-20 US disclosed
US-6723868-B1 REDUCING 2-AZABICYCLO(2.2.1)HEPT-5-EN-1-ONE WITH LITHIUM BOROHYDRIDE TO FORM 1-AMINO-4-(HYDROXYMETHYL)-2- CYCLOPENTENE LONZA AG (CH) 2004-04-20 US disclosed
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 disclosed
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 disclosed
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 disclosed
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 disclosed
US-6252112-B1 MIBCROBIAL HYDROLYSIS OF THE TITLE COMPOUND DERIVATIVE USING ENZYME HAVING N-ACETYLAMINO-ALCOHOL HYDROLASE OR PENICILLIN G ACYLASE ACTIVITY WITH SUBSEQUENT ACYLATION LONZA A.G., (CH) 2001-06-26 US disclosed
JP-H11228510-A PREPARATION OF AMINOALCOHOL DERIVATIVE AND ITS CONVERSION TO (1R,4S)-4-((2-AMINO-6-CHLORO-5-FORMAMIDO-4-PYRIDIDYL) AMINO)-2-CYCLOPENTENYL-1-METHANOL LONZA AG 1999-08-24 JP disclosed
CN-1218795-A Process for the preparation of aminoalcohol derivatives and their further conversion to (1R,4S) -4- ((2-amino-6-chloro-5-formylamino-4-pyrimidinyl) amino) -2-cyclopentenyl-1-methanol LONZA AG (CH) 1999-06-09 CN disclosed
CN-1218795-A Process for the preparation of aminoalcohol derivatives and their further conversion to (1R,4S) -4- ((2-amino-6-chloro-5-formylamino-4-pyrimidinyl) amino) -2-cyclopentenyl-1-methanol LONZA AG (CH) 1999-06-09 CN 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-20070123545-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 GART, AASDHPPT, TYMS NR1I2 1865/4885ALB 2272/4885PDE4D 734/4885
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-20060211862-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 GART, AASDHPPT, TYMS NR1I2 1865/4885ALB 2272/4885PDE4D 734/4885

“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.