SCHEMBL7360403

SCHEMBL7360403

CSCC[C@@H](N)C(O)C(=O)NCCc1cccnc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.48
ADAM17 P78536 1/20 0.46
LAP3 P28838 2/20 0.45
ANPEP P15144 1/20 0.45
RNPEP Q9H4A4 1/20 0.45
DNPEP Q9ULA0 1/20 0.45
METAP2 P50579 2/20 0.44
TLR2 O60603 1/20 0.44
METAP1 P53582 1/20 0.44
HDAC2 Q92769 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
CYP3A4 P08684 5/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
PKM P14618 1/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42

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
SCHEMBL7353083 0.86 METAP2 (0.47) HDAC8LAP3ANPEPRNPEPDNPEP
SCHEMBL7356058 0.79 TSHR (0.51) LAP3ANPEPRNPEPDNPEPMETAP2
SCHEMBL7352471 0.78 LAP3 (0.53) LAP3ANPEPRNPEPDNPEPMETAP2
SCHEMBL7358146 0.78 LAP3 (0.53) LAP3ANPEPRNPEPDNPEPMETAP2
Hydrochloric Acid SCHEMBL7354903 0.78 TSHR (0.50) LAP3ANPEPRNPEPDNPEPMETAP2
Hydrochloric Acid SCHEMBL7360809 0.77 LAP3 (0.52) LAP3ANPEPRNPEPDNPEPMETAP2
SCHEMBL7350104 0.77 SMN1; SMN2 (0.51) METAP2METAP1KMT2ASMN1; SMN2FNTA
SCHEMBL7352540 0.77 METAP2 (0.51) LAP3ANPEPRNPEPDNPEPMETAP2
Hydrochloric Acid SCHEMBL7507006 0.76 SMN1; SMN2 (0.50) METAP2METAP1KMT2ASMN1; SMN2FNTA
Hydrochloric Acid SCHEMBL7355464 0.76 SMN1; SMN2 (0.50) METAP2METAP1KMT2ASMN1; SMN2FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1073633-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 2001-02-07 EP claimed
WO-1999057098-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 1999-11-11 WO claimed
US-6242494-B1 ANGIOGENESIS INHIBITORS, ANTITUMOR AGENTS, DIABETIC RETINOPATHY, AND ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES 2001-06-05 US disclosed
EP-1073633-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 2001-02-07 EP disclosed
WO-1999057098-A2 SUBSTITUTED BETA-AMINO ACID INHIBITORS OF METHIONINE AMINOPEPTIDASE-2 ABBOTT LABORATORIES (US) 1999-11-11 WO disclosed