SCHEMBL5500011

SCHEMBL5500011

CC(C)C(NC(=O)CNC(=O)C(CCCNC(=N)N)NC(=O)C(Cc1ccc(O)cc1)NC(=O)C(Cc1c[nH]cn1)NC(=O)C(N)CCCCN)C(=O)NC(CCCNC(=N)N)C(=O)NC(CCC(N)=O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ C5AR1 P21730 2/20 0.58
▸ GLP1R P43220 5/20 0.53
▸ SCTR P47872 1/20 0.53
▸ TFPI P10646 1/20 0.52
▸ NPY4R P50391 6/20 0.51
▸ NPY1R P25929 5/20 0.51
▸ NPY2R P49146 4/20 0.51
▸ NPY5R Q15761 4/20 0.51
▸ MC4R P32245 1/20 0.51
▸ IL23R Q5VWK5 4/20 0.50
▸ GCGR P47871 1/20 0.50

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
SCHEMBL5500020 1.00 C5AR1 (0.58) C5AR1GLP1RSCTRTFPINPY4R
SCHEMBL29716050 0.94 GLP1R (0.62) C5AR1GLP1RSCTRTFPIGCGR
SCHEMBL30512627 0.90 TFPI (0.64) C5AR1GLP1RSCTRTFPIMC4R
SCHEMBL31680257 0.90 C5AR1 (0.58) C5AR1GLP1RSCTRTFPINPY4R
SCHEMBL30567797 0.90 TFPI (0.62) TFPINPY4RNPY1RNPY2RNPY5R
SCHEMBL30307617 0.89 GLP1R (0.64) GLP1RSCTRTFPIGCGR
SCHEMBL30424730 0.88 C5AR1 (0.53) C5AR1GLP1RSCTRTFPINPY4R
SCHEMBL30974468 0.88 NPY4R (0.53) C5AR1GLP1RSCTRNPY4RNPY1R
SCHEMBL29871041 0.88 GLP1R (0.59) C5AR1GLP1RSCTRTFPIGCGR
SCHEMBL29904562 0.87 C5AR1 (0.55) C5AR1GLP1RSCTRNPY4RNPY1R

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
EP-1635629-A4 PLANT TRANSCRIPTIONAL REGULATORS OF DISEASE RESISTANCE MENDEL BIOTECHNOLOGY INC (US) 2007-10-03 — — EP disclosed
EP-1635629-A2 PLANT TRANSCRIPTIONAL REGULATORS OF DISEASE RESISTANCE Mendel Biotechnology, Inc. (US) 2006-03-22 — — EP disclosed
WO-2004108900-A2 PLANT TRANSCRIPTIONAL REGULATORS OF DISEASE RESISTANCE MENDEL BIOTECHNOLOGY, INC. (US) 2004-12-16 — — WO disclosed
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