SCHEMBL8720265

SCHEMBL8720265

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 3/20 0.44
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.36
RAB9A P51151 1/20 0.36
OPRM1 P35372 1/20 0.36
OPRD1 P41143 1/20 0.36
OPRK1 P41145 1/20 0.36
CTSB P07858 3/20 0.35
ITGB2 P05107 1/20 0.35
ICAM1 P05362 1/20 0.35
ITGAL P20701 1/20 0.35
SLC15A2 Q16348 1/20 0.34
CA2 P00918 3/20 0.34
CA1 P00915 2/20 0.34
PTGS1 P23219 1/20 0.34
GSTK1 Q9Y2Q3 1/20 0.34
MMP8 P22894 1/20 0.33
QRFPR Q96P65 1/20 0.32

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
SCHEMBL901315 1.00 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8717807 1.00 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8717768 0.97 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8717867 0.97 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL9228209 0.97 ECE1 (0.44) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL18109901 0.97 ECE1 (0.43) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8087169 0.97 ECE1 (0.46) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL8200006 0.97 ECE1 (0.43) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL700301 0.97 ECE1 (0.46) ECE1MEN1KMT2AALDH1A1RAB9A
SCHEMBL5820202 0.97 ECE1 (0.46) ECE1MEN1KMT2AALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5763254-A ENDOGENOUS TO STRAIN OF FUNGUS OTHER THAN TRICHODERMA OR PHANEROCHAETE NOVO NORDISK A/S (DK) 1998-06-09 US claimed
US-5457046-A Polypeptides NOVO NORDISK A/S (DK) 1995-10-10 US claimed
US-5457046-A Polypeptides NOVO NORDISK A/S (DK) 1995-10-10 US disclosed