SCHEMBL7778685

SCHEMBL7778685

C[C@@H](NC(=O)C(N)Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.70
MAPT P10636 2/20 0.70
MEN1 O00255 1/20 0.70
LMNA P02545 1/20 0.70
MPO P05164 1/20 0.70
TSHR P16473 1/20 0.70
BLM P54132 1/20 0.70
PMP22 Q01453 1/20 0.70
KMT2A Q03164 1/20 0.70
HIF1A Q16665 1/20 0.70
APAF1 O14727 1/20 0.62
POLB P06746 1/20 0.62
RECQL P46063 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
ACE P12821 2/20 0.61
OPRM1 P35372 2/20 0.58
OPRD1 P41143 2/20 0.58
SDCBP O00560 1/20 0.58
SDC2 P34741 1/20 0.58
CTSC P53634 2/20 0.57

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
SCHEMBL11580346 1.00 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
SCHEMBL9499905 1.00 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
SCHEMBL1617917 1.00 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
SCHEMBL7781160 1.00 KDM4E (0.70) KDM4EMAPTMEN1LMNAMPO
Water SCHEMBL29655419 0.99 KDM4E (0.68) KDM4EMAPTMEN1LMNAMPO
Water SCHEMBL7631043 0.99 KDM4E (0.68) KDM4EMAPTMEN1LMNAMPO
SCHEMBL30051936 0.98 KDM4E (0.67) KDM4EMAPTMEN1LMNAMPO
SCHEMBL30051359 0.94 ACE (0.64) KDM4EMAPTMEN1LMNAMPO
SCHEMBL30052771 0.93 KDM4E (0.61) KDM4EMAPTMEN1LMNAMPO
SCHEMBL31454970 0.92 KDM4E (0.60) KDM4EMAPTMEN1LMNAMPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633267-B1 Process for the preparation of alpha-amino acid amide for use in peptide synthesis SOLVAY (BE) 2001-09-26 EP disclosed
US-5506362-A Process for the preparation of an α-amino acid amide SOLVAY (SOCIETE ANONYME) (BE) 1996-04-09 US disclosed
EP-0633267-A1 Process for the preparation of an alpha-amino acid amide for use in peptide synthesis SOLVAY (Société Anonyme) (BE) 1995-01-11 EP disclosed
US-4087416-A LUTEINIZING HORMONE RELEASING FACTOR ANTAGONISTS PARKE, DAVIS & COMPANY (US) 1978-05-02 US disclosed