SCHEMBL5090551

SCHEMBL5090551

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

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL497180 1.00
SCHEMBL12327087 1.00
Hydrochloric Acid SCHEMBL18954319 0.97
SCHEMBL21676970 0.75
SCHEMBL6120496 0.73
SCHEMBL23737642 0.73
SCHEMBL12555028 0.73
SCHEMBL9188946 0.72 HTR2A (0.48)
SCHEMBL16240 0.72
SCHEMBL159060 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200216417-A1 INHIBITORS OF FIBROBLAST ACTIVATION PROTEIN INTEGRAL BIOSCIENCES PVT. LTD. (IN) 2020-07-09 US disclosed
EP-2348125-B1 Method for the synthesis of a bifunctional complex NUEVOLUTION AS (DK) 2017-06-21 EP disclosed
US-8206901-B2 Method for the synthesis of a bifunctional complex NUEVOLUTION A/S (DK) 2012-06-26 US disclosed
US-8206901-B2 Method for the synthesis of a bifunctional complex NUEVOLUTION A/S (DK) 2012-06-26 US disclosed
EP-2348124-A2 Synthesis of a bifunctional complex Nuevolution A/S (DK) 2011-07-27 EP disclosed
EP-2348125-A2 Method for the synthesis of a bifunctional complex Nuevolution A/S (DK) 2011-07-27 EP disclosed
EP-1558744-B1 ENZYMATIC ENCODING NUEVOLUTION AS (DK) 2011-06-15 EP disclosed
US-7405201-B2 Antibacterial macrocycles BAYER HEALTHCARE AG (DE) 2008-07-29 US disclosed
EP-1430075-B1 ANTIBACTERIAL MACROCYCLES BAYER HEALTHCARE AG (DE) 2007-01-03 EP disclosed
US-20050107288-A1 Antibacterial macrocycles BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2005-05-19 US disclosed
EP-1430075-A2 ANTIBACTERIAL MACROCYCLES Bayer HealthCare AG (DE) 2004-06-23 EP disclosed
WO-2003024996-A2 ANTIBACTERIAL MACROCYCLES BAYER HEALTHCARE AG (DE) 2003-03-27 WO disclosed