SCHEMBL3248461

SCHEMBL3248461

CCCC[C@H](NC)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.52
CA1 P00915 4/20 0.52
DPP7 Q9UHL4 4/20 0.40
SLC15A1 P46059 1/20 0.40
TLR8 Q9NR97 1/20 0.39
MAPK1 P28482 1/20 0.39
SLC1A3 P43003 1/20 0.37
SLC1A2 P43004 1/20 0.37
SLC1A1 P43005 1/20 0.37
EPHX1 P07099 1/20 0.37
DPP8 Q6V1X1 3/20 0.37
DPP4 P27487 2/20 0.37
DPP9 Q86TI2 2/20 0.37
NOD1 Q9Y239 1/20 0.36
METAP1 P53582 1/20 0.36

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
SCHEMBL14687523 1.00 CA2 (0.52) CA2CA1DPP7SLC15A1TLR8
SCHEMBL14819788 0.94 CA1 (0.45) CA2CA1DPP7SLC1A2SLC1A1
SCHEMBL16327658 0.92 GPR84 (0.44) CA2CA1EPHX1
SCHEMBL22577460 0.92 GPR84 (0.44) CA2CA1EPHX1
SCHEMBL31520092 0.92 GPR84 (0.44) CA2CA1EPHX1
SCHEMBL3867719 0.86
SCHEMBL2420397 0.86
SCHEMBL14345861 0.84 CA2 (0.43) CA2CA1DPP7SLC15A1MAPK1
SCHEMBL10016030 0.84 CA2 (0.43) CA2CA1DPP7SLC15A1MAPK1
Hydrochloric Acid SCHEMBL28241321 0.84 CA1 (0.39) CA2CA1DPP7SLC1A3SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160244484-A1 ANTI-INFLAMMATORY TRIPEPTIDES DR. AUGUST WOLFF GMBH & CO. KG ARZNEIMITTEL (DE) 2016-08-25 US claimed
WO-2011149995-A1 NOVEL SUBSTITUTED OCTAHYDROCYCLOPENTA [C]PYRROL-4-AMINES AS CALCIUM CHANNEL BLOCKERS ABBOTT LABORATORIES (US) 2011-12-01 WO claimed
US-12030888-B2 Himastatin derivatives, and processes of preparation thereof, and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2024-07-09 US disclosed
US-20230365628-A1 MACROCYCLIC IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-16 US disclosed
US-20230365627-A1 MACROCYCLIC PEPTIDE BORONATE IMMUNOMODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2023-11-16 US disclosed
US-20230183292-A1 IMMUNOMODULATORS BRISTOL MYERS SQUIBB CO (US) 2023-06-15 US disclosed
EP-4092038-A1 OPIOID AGONIST PEPTIDES AND USES THEREOF Protagonist Therapeutics, Inc. (US) 2022-11-23 EP disclosed
US-20220289750-A1 HIMASTATIN DERIVATIVES, AND PROCESSES OF PREPARATION THEREOF, AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2022-09-15 US disclosed
US-10954269-B2 Anti-inflammatory tripeptides DR. AUGUST WOLFF GMBH & CO. KG ARZNEIMITTEL (DE) 2021-03-23 US disclosed
US-20190153029-A1 ANTI-INFLAMMATORY TRIPEPTIDES DR. AUGUST WOLFF GMBH & CO. KG ARZNEIMITTEL (DE) 2019-05-23 US disclosed
US-20160244484-A1 ANTI-INFLAMMATORY TRIPEPTIDES DR. AUGUST WOLFF GMBH & CO. KG ARZNEIMITTEL (DE) 2016-08-25 US disclosed
US-20030229024-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis AUDIA JAMES E (US) 2003-12-11 US disclosed
US-6476263-B1 Compounds for inhibiting β-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. 2002-11-05 US disclosed
US-20020052322-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis ELAN PHARMACEUTICALS, INC. 2002-05-02 US disclosed
US-6211235-B1 ALZHEIMERS DISEASE ELAN PHARMACEUTICALS, INC. 2001-04-03 US disclosed
US-6207710-B1 FOR THERAPY OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-03-27 US disclosed
US-6191166-B1 ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. 2001-02-20 US disclosed
EP-0942924-A2 METHODS AND COMPOUNDS FOR INHIBITING $g(b)-AMYLOID PEPTIDE RELEASE AND/OR ITS SYNTHESIS Elan Pharmaceuticals, Inc. (US) 1999-09-22 EP disclosed
WO-1998022494-A9 METHODS AND COMPOUNDS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR SYNTHESIS 1998-08-20 WO disclosed
WO-1998022494-A2 METHODS AND COMPOUNDS FOR INHIBITING β-AMYLOID PEPTIDE RELEASE AND/OR SYNTHESIS ELAN PHARMACEUTICALS, INC. (US) 1998-05-28 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 (10 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-12030888-B2 Himastatin derivatives, and processes of preparation thereof, and uses thereof PCSK9, HMGCR, PCSK7 CA2 2553/4885CA1 3610/4885DPP7 321/4885
US-20020052322-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis APP, BACE1, IAPP CA2 1983/4885CA1 208/4885DPP7 110/4885
US-20160244484-A1 ANTI-INFLAMMATORY TRIPEPTIDES VIP, TNF, ENPEP CA2 1882/4885CA1 1289/4885DPP7 27/4885
US-20230365627-A1 MACROCYCLIC PEPTIDE BORONATE IMMUNOMODULATORS CD274, PDCD1, PDCD1LG2 CA2 4500/4885CA1 4069/4885DPP7 1173/4885
US-20190153029-A1 ANTI-INFLAMMATORY TRIPEPTIDES VIP, TNF, ENPEP CA2 1882/4885CA1 1289/4885DPP7 27/4885
US-20030229024-A1 Methods and compounds for inhibiting beta-amyloid peptide release and/or its synthesis APP, BACE1, IAPP CA2 1983/4885CA1 208/4885DPP7 110/4885
US-10954269-B2 Anti-inflammatory tripeptides VIP, TNF, ENPEP CA2 1882/4885CA1 1289/4885DPP7 27/4885
US-20230183292-A1 IMMUNOMODULATORS CD274, PDCD1LG2, PDCD1 CA2 4879/4885CA1 4876/4885DPP7 1354/4885
US-20230365628-A1 MACROCYCLIC IMMUNOMODULATORS CD274, PDCD1, PDCD1LG2 CA2 4879/4885CA1 4798/4885DPP7 869/4885
US-20220289750-A1 HIMASTATIN DERIVATIVES, AND PROCESSES OF PREPARATION THEREOF, AND USES THEREOF PCSK9, HMGCR, PCSK7 CA2 2553/4885CA1 3610/4885DPP7 321/4885

“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.