SCHEMBL7432155

SCHEMBL7432155

CC[C@H](C)[C@H](N)C(=O)NCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.57
KMT2A Q03164 4/20 0.55
MME P08473 1/20 0.51
MEN1 O00255 3/20 0.50
ALDH1A1 P00352 2/20 0.50
MAPT P10636 1/20 0.50
SLC1A2 P43004 1/20 0.50
CYP3A4 P08684 1/20 0.50
GAA P10253 1/20 0.49

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
SCHEMBL8155147 1.00 ANPEP (0.57) ANPEPKMT2AMMEMEN1ALDH1A1
SCHEMBL4746610 1.00 ANPEP (0.57) ANPEPKMT2AMMEMEN1ALDH1A1
Hydrochloric Acid SCHEMBL8617723 0.98 ANPEP (0.56) ANPEPKMT2AMMEMEN1ALDH1A1
Hydrochloric Acid SCHEMBL8617714 0.98 ANPEP (0.56) ANPEPKMT2AMMEMEN1ALDH1A1
Glycine SCHEMBL29077112 0.94 ANPEP (0.52) ANPEPKMT2AMMEMEN1ALDH1A1
Glycerin SCHEMBL29077115 0.92 ANPEP (0.50) ANPEPKMT2AMMEMEN1ALDH1A1
Hydrochloric Acid SCHEMBL8617140 0.90 BACE1 (0.55) ANPEPKMT2AMMEMEN1ALDH1A1
Hydrochloric Acid SCHEMBL8617134 0.90 BACE1 (0.55) ANPEPKMT2AMMEMEN1ALDH1A1
SCHEMBL3668459 0.86 CA1 (0.47) ANPEPKMT2AMMEMEN1
SCHEMBL4747242 0.86 MEN1 (0.56) ANPEPKMT2AMEN1ALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116574154-A Cyclic peptide-lenalidomide PROTAC derivative, preparation method thereof and application thereof in anticancer drugs 哈尔滨师范大学 2023-08-11 CN claimed
CN-116574154-A Cyclic peptide-lenalidomide PROTAC derivative, preparation method thereof and application thereof in anticancer drugs 哈尔滨师范大学 2023-08-11 CN disclosed
CN-111057128-B Sulfur-containing isoindolone cyclic peptide derivative and preparation method thereof 哈尔滨师范大学 2023-05-16 CN disclosed
WO-2008107365-A1 NEW COMPOUNDS MEDIVIR AB (SE) 2008-09-12 WO disclosed
WO-1999024461-A1 CLOSTRIDIAL TOXIN INHIBITORS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 1999-05-20 WO disclosed
EP-0564924-B1 2-Oxoethyl derivatives as immunosuppressants BAYER AG (US) 1998-09-09 EP disclosed
EP-0610743-B1 Aminomethylene-peptides as immunosuppressants BAYER AG (US) 1998-09-09 EP disclosed
EP-0838471-A1 PEPTIDE DERIVATIVES AND ANGIOTENSIN IV RECEPTOR AGONIST SAGAMI CHEMICAL RESEARCH CENTER (JP) 1998-04-29 EP disclosed
US-5686424-A FOR TREATING INFLAMMATION MILES INC. (US) 1997-11-11 US disclosed
US-5385918-A Aminomethylene-peptides as immunosuppressants MILES INC. (US) 1995-01-31 US disclosed
EP-0610743-A1 Novel aminomethylene-peptides as immunosuppressants Bayer Corporation (US) 1994-08-17 EP disclosed
US-5296604-A Proline derivatives and compositions for their use as inhibitors of HIV protease MILES INC. (US) 1994-03-22 US disclosed
EP-0564924-A2 2-Oxoethyl derivatives as immunosuppressants Bayer Corporation (US) 1993-10-13 EP disclosed
EP-0386611-A2 Amino acid derivatives F. HOFFMANN-LA ROCHE AG (CH) 1990-09-12 EP disclosed