SCHEMBL598397

SCHEMBL598397

O=C1CC[C@H](Cc2ccc(-c3ccccc3)cc2)N1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.54
DDB1 Q16531 1/20 0.46
CRBN Q96SW2 1/20 0.46
KCNA5 P22460 2/20 0.44
CYP26A1 O43174 1/20 0.43
CD274 Q9NZQ7 4/20 0.42
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39

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
SCHEMBL597775 1.00 CTSD (0.54) CTSDDDB1CRBNKCNA5CYP26A1
SCHEMBL597776 1.00 CTSD (0.54) CTSDDDB1CRBNKCNA5CYP26A1
SCHEMBL19419777 0.90 CTSD (0.59) CTSDDDB1CRBNKCNA5POLB
SCHEMBL8270781 0.90 CTSD (0.59) CTSDDDB1CRBNKCNA5POLB
SCHEMBL2132646 0.90 CTSD (0.59) CTSDDDB1CRBNKCNA5POLB
Tert-Butyl Formate SCHEMBL28003304 0.86 CTSD (0.47) CTSDDDB1CRBNKCNA5CYP26A1
Tert-Butyl Formate SCHEMBL28003305 0.86 CTSD (0.47) CTSDDDB1CRBNKCNA5CYP26A1
SCHEMBL14932461 0.84 KCNA5 (0.49) CTSDKCNA5CD274
SCHEMBL18409007 0.84 KCNA5 (0.43) CTSDKCNA5CD274
SCHEMBL23459341 0.82 CTSD (0.58) CTSDDDB1CRBNPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117285442-A Preparation method of sakuba intermediate LCZ696 intermediate 安徽迪合永欣药业有限公司 2023-12-26 CN claimed
CN-115974725-A Method for preparing pharmaceutical intermediate 深圳市祥根生物医药有限公司 2023-04-18 CN claimed
CN-117285442-A Preparation method of sakuba intermediate LCZ696 intermediate 安徽迪合永欣药业有限公司 2023-12-26 CN disclosed
CN-117285442-A Preparation method of sakuba intermediate LCZ696 intermediate 安徽迪合永欣药业有限公司 2023-12-26 CN disclosed
CN-115974725-A Method for preparing pharmaceutical intermediate 深圳市祥根生物医药有限公司 2023-04-18 CN disclosed
CN-115974725-A Method for preparing pharmaceutical intermediate 深圳市祥根生物医药有限公司 2023-04-18 CN disclosed
EP-2121578-B1 PROCESS FOR PREPARING 5-BIPHENYL-4-AMINO-2-METHYL PENTANOIC ACID NOVARTIS AG (CH) 2016-08-10 EP disclosed
US-9206116-B2 Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS AG (CH) 2015-12-08 US disclosed
US-20150166468-A1 Process for Preparing 5-biphenyl-4-amino-2-methyl Pentanoic Acid NOVARTIS AG (CH) 2015-06-18 US disclosed
US-8993785-B2 Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS AG (CH) 2015-03-31 US disclosed
CN-101631765-B Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS AG (CH) 2014-10-01 CN disclosed
US-20140249320-A1 Process for Preparing 5-biphenyl-4-amino-2-methyl Pentanoic Acid NOVARTIS AG (CH) 2014-09-04 US disclosed
US-8716495-B2 Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS AG (CH) 2014-05-06 US disclosed
US-20120142916-A1 PROCESS FOR PREPARING 5-BIPHENYL-4-AMINO-2-METHYL PENTANOIC ACID NOVARTIS AG (CH) 2012-06-07 US disclosed
US-8115016-B2 Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS AG (CH) 2012-02-14 US disclosed
US-20100113801-A1 Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid NOVARTIS PHARMACEUTICALS CORPORATION 2010-05-06 US disclosed
EP-2121578-A2 NEW PROCESS Novartis AG (CH) 2009-11-25 EP disclosed
WO-2008083967-A2 PROCESS FOR PREPARING 5-BIPHENYL-4-AMINO-2-METHYL PENTANOIC ACID NOVARTIS AG (CH) 2008-07-17 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-20100113801-A1 Process for preparing 5-biphenyl-4-amino-2-methyl pentanoic acid MME, REN, PAH CTSD 2264/4885DDB1 3871/4885CRBN 1031/4885
US-20120142916-A1 PROCESS FOR PREPARING 5-BIPHENYL-4-AMINO-2-METHYL PENTANOIC ACID MME, REN, PAH CTSD 2264/4885DDB1 3871/4885CRBN 1031/4885
US-20140249320-A1 Process for Preparing 5-biphenyl-4-amino-2-methyl Pentanoic Acid MME, REN, PAH CTSD 2264/4885DDB1 3871/4885CRBN 1031/4885
US-20150166468-A1 Process for Preparing 5-biphenyl-4-amino-2-methyl Pentanoic Acid MME, REN, PAH CTSD 2264/4885DDB1 3871/4885CRBN 1031/4885

“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.