SCHEMBL2184423

SCHEMBL2184423

N[C@H](C(=O)N[C@H](C(=O)O)c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.49
CA2 P00918 3/20 0.49
LTA4H P09960 1/20 0.48
ANPEP P15144 1/20 0.48
FPR2 P25090 1/20 0.47
NAALAD2 Q9Y3Q0 1/20 0.46
LMNA P02545 2/20 0.45
MAPK1 P28482 1/20 0.45
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC7 Q8WUI4 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
HDAC9 Q9UKV0 1/20 0.44
HDAC5 Q9UQL6 1/20 0.44
CTSD P07339 1/20 0.44
MMP12 P39900 1/20 0.43
MMP13 P45452 1/20 0.43
CCNA2 P20248 1/20 0.43

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
Hydrochloric Acid SCHEMBL10940439 0.98 CA1 (0.48) CA1CA2LTA4HANPEPFPR2
Bromide SCHEMBL10942750 0.98 CA1 (0.48) CA1CA2LTA4HANPEPFPR2
SCHEMBL11346714 0.86 YARS1 (0.53) CA1CA2LTA4HANPEPNAALAD2
Bromide SCHEMBL11358087 0.84 YARS1 (0.52) CA1CA2LTA4HANPEPNAALAD2
SCHEMBL3175279 0.84 CTRB1 (0.59) CA1CA2LTA4HANPEPFPR2
SCHEMBL31656407 0.84 CTRB1 (0.59) CA1CA2LTA4HANPEPFPR2
SCHEMBL2739527 0.81 LTA4H (0.48) CA1CA2LTA4HANPEPFPR2
SCHEMBL22503749 0.80 MME (0.56) LTA4HANPEPLMNACTRB1
SCHEMBL5970334 0.80 MMP2 (0.49) CA1CA2LTA4HANPEPFPR2
SCHEMBL31181302 0.80 NAALAD2 (0.49) CA1CA2LTA4HANPEPFPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0069894-B1 OPTICALLY ACTIVE DIPEPTIDES, PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1985-04-10 EP claimed
US-4505854-A Optically active dipeptides and the use thereof as tissue dissolving and histolytic agent in human beings NATTERMANN & CIE GMBH (DE) 1985-03-19 US claimed
EP-0069894-A1 Optically active dipeptides, pharmaceutically acceptable salts thereof, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1983-01-19 EP claimed
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2019-03-07 US disclosed
US-9682153-B2 Polymer conjugates of therapeutic peptides NEKTAR THERAPEUTICS (US) 2017-06-20 US disclosed
US-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS 2016-01-28 US disclosed
US-9173951-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2015-11-03 US disclosed
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2015-02-19 US disclosed
US-8680263-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2014-03-25 US disclosed
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE NEKTAR THERAPEUTICS (US) 2011-07-14 US disclosed
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 US disclosed
EP-0069894-B1 OPTICALLY ACTIVE DIPEPTIDES, PHARMACEUTICALLY ACCEPTABLE SALTS THEREOF, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM A. Nattermann & Cie. GmbH (DE) 1985-04-10 EP disclosed
US-4505854-A Optically active dipeptides and the use thereof as tissue dissolving and histolytic agent in human beings NATTERMANN & CIE GMBH (DE) 1985-03-19 US disclosed
US-4505854-A Optically active dipeptides and the use thereof as tissue dissolving and histolytic agent in human beings NATTERMANN & CIE GMBH (DE) 1985-03-19 US disclosed
EP-0069894-A1 Optically active dipeptides, pharmaceutically acceptable salts thereof, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1983-01-19 EP disclosed
EP-0069894-A1 Optically active dipeptides, pharmaceutically acceptable salts thereof, process for their preparation and pharmaceutical compositions containing them A. Nattermann & Cie. GmbH (DE) 1983-01-19 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 (6 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-20160022828-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CA1 905/4885CA2 3392/4885LTA4H 2136/4885
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST CA1 319/4885CA2 1164/4885LTA4H 4098/4885
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST CA1 319/4885CA2 1164/4885LTA4H 4098/4885
US-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CA1 905/4885CA2 3392/4885LTA4H 2136/4885
US-20190070251-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CA1 905/4885CA2 3392/4885LTA4H 2136/4885
US-20110171312-A1 MODIFIED THERAPEUTIC PEPTIDES, METHODS OF THEIR PREPARATION AND USE DNPEP, VIP, PTMS CA1 386/4885CA2 2476/4885LTA4H 3117/4885

“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.