SCHEMBL196730

SCHEMBL196730

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
MME P08473 2/20 0.38
ACE P12821 2/20 0.38
CPA1 P15085 2/20 0.38
ACE2 Q9BYF1 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.34
CHRNB2 P17787 6/20 0.33
CHRNA4 P43681 6/20 0.33
CHRNB4 P30926 5/20 0.33
TP53 P04637 1/20 0.33
GRIN2D O15399 2/20 0.33
GRIN1 Q05586 2/20 0.33
GRIN2A Q12879 2/20 0.33
GRIN2B Q13224 2/20 0.33
GRIN2C Q14957 2/20 0.33
OPRM1 P35372 2/20 0.33
CACNA1F O60840 1/20 0.33
ABCB1 P08183 1/20 0.33
CYP2B6 P20813 1/20 0.33
DRD4 P21917 1/20 0.33

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
SCHEMBL14889910 1.00 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL3527314 1.00 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL196729 1.00 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL3149648 1.00 ALDH1A1 (0.39) ALDH1A1MMEACECPA1ACE2
SCHEMBL17772985 0.84 ALDH1A1 (0.38) ALDH1A1MMEACECPA1ACE2
SCHEMBL3154732 0.82 ALDH1A1 (0.37) ALDH1A1MMEACECPA1ACE2
SCHEMBL8708558 0.82 ALDH1A1 (0.37) ALDH1A1MMEACECPA1ACE2
SCHEMBL3156914 0.82 ALDH1A1 (0.37) ALDH1A1MMEACECPA1ACE2
SCHEMBL28389417 0.82 ALDH1A1 (0.37) ALDH1A1MMEACECPA1ACE2
SCHEMBL3154725 0.82 ALDH1A1 (0.37) ALDH1A1MMEACECPA1ACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240036055-A1 Multiplexed DiLeu-Biotin-Azide (DBA) Tag Enabled Isobaric Tandem Orthogonal Proteolysis Activity-Based Protein Profiling (isoBOP-ABPP) Platform For High-Throughput Quantitative Pan-PTM Analysis WISCONSIN ALUMNI RESEARCH FOUNDATION 2024-02-01 US claimed
US-20160244484-A1 ANTI-INFLAMMATORY TRIPEPTIDES DR. AUGUST WOLFF GMBH & CO. KG ARZNEIMITTEL (DE) 2016-08-25 US claimed
EP-3049428-A1 ANTI-INFLAMMATORY TRIPEPTIDES Dr. August Wolff GmbH & Co. KG Arzneimittel (DE) 2016-08-03 EP claimed
WO-2015040235-A1 ANTI-INFLAMMATORY TRIPEPTIDES DR. AUGUST WOLFF GMBH & CO. KG ARZNEIMITTEL (DE) 2015-03-26 WO claimed
EP-2477962-A1 PRODRUGS OF GUANFACINE Shire LLC (US) 2012-07-25 EP claimed
US-20120178666-A1 PRODRUGS OF GUANFACINE SHIRE LLC (US) 2012-07-12 US claimed
WO-2011033296-A1 PRODRUGS OF GUANFACINE SHIRE LLC (US) 2011-03-24 WO claimed
US-20110065796-A1 PRODRUGS OF GUANFACINE SHIRE LLC (US) 2011-03-17 US claimed
EP-0842142-B1 PROCESS FOR PRODUCING ALPHA-(N,N DIALKYL)-AMINO CARBOXYLIC ACID AMIDES BASF AG (DE) 2001-09-26 EP claimed
US-5945543-A REACTING CORRESPONDING FREE ACIDS WITH PRIMARY OR SECONDARY AMINES IN THE PRESENCE OF ANHYDRIDES OF AN ALKANEPHOSPHONIC ACID BASF AKTIENGESELLSCHAFT (DE) 1999-08-31 US claimed
EP-0842142-A1 PROCESS FOR PRODUCING $g(a)-(N,N DIALKYL)-AMINO CARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 1998-05-20 EP claimed
WO-1997005096-A1 PROCESS FOR PRODUCING α-(N,N DIALKYL)-AMINO CARBOXYLIC ACID AMIDES BASF AKTIENGESELLSCHAFT (DE) 1997-02-13 WO claimed
US-12427472-B2 Process for removal of acid gases from a fluid stream BASF SE (DE) 2025-09-30 US disclosed
CN-114173908-B Method for removing acid gases from fluid streams 巴斯夫欧洲公司 2025-04-01 CN disclosed
US-12138583-B2 Process for removal of acid gases from a fluid stream with a liquid absorbent comprising a piperazine ring BASF SE (DE) 2024-11-12 US disclosed
US-20240042375-A1 PROCESS FOR REMOVAL OF ACID GASES FROM A FLUID STREAM BASF SE (DE) 2024-02-08 US disclosed
WO-1996040751-A1 NOVEL DOLASTATIN DERIVATIVES, THEIR PREPARATION AND USE BASF AKTIENGESELLSCHAFT (DE) 1996-12-19 WO disclosed
WO-1996040752-A1 NOVEL DOLASTATIN DERIVATIVES, THEIR PREPARATION AND USE BASF AKTIENGESELLSCHAFT (DE) 1996-12-19 WO disclosed
EP-0674652-A1 DOLOSTATIN ANALOG BASF AKTIENGESELLSCHAFT (DE) 1995-10-04 EP disclosed
WO-1994013695-A1 DOLOSTATIN ANALOG BASF AKTIENGESELLSCHAFT (DE) 1994-06-23 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 (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-12427472-B2 Process for removal of acid gases from a fluid stream C5, C1S, C9 ALDH1A1 469/4885MME 942/4885ACE 1998/4885
US-20160244484-A1 ANTI-INFLAMMATORY TRIPEPTIDES VIP, TNF, ENPEP ALDH1A1 2456/4885MME 202/4885ACE 535/4885
US-20240042375-A1 PROCESS FOR REMOVAL OF ACID GASES FROM A FLUID STREAM C5, C1S, C9 ALDH1A1 469/4885MME 942/4885ACE 1998/4885
US-20120178666-A1 PRODRUGS OF GUANFACINE DNPEP, VIP, GDA ALDH1A1 677/4885MME 62/4885ACE 49/4885
US-12138583-B2 Process for removal of acid gases from a fluid stream with a liquid absorbent comprising a piperazine ring AVPR2, HRH2, SLC43A1 ALDH1A1 275/4885MME 3622/4885ACE 4290/4885
US-20110065796-A1 PRODRUGS OF GUANFACINE DNPEP, VIP, GDA ALDH1A1 677/4885MME 62/4885ACE 49/4885

“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.