SCHEMBL12337845

SCHEMBL12337845

CC(=O)SCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)N[C@H](C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)C1CC[C@@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)N1)[C@@H](C)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RAMP3 O60896 8/20 0.46
▸ CALCR P30988 8/20 0.46
▸ APLNR P35414 1/20 0.45
▸ IL23R Q5VWK5 1/20 0.44
▸ KDM1A O60341 1/20 0.44
▸ MAOB P27338 1/20 0.44
▸ KDM5A P29375 1/20 0.44
▸ KDM1B Q8NB78 1/20 0.44
▸ NMUR2 Q9GZQ4 2/20 0.40
▸ NMUR1 Q9HB89 2/20 0.40

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
SCHEMBL12337799 0.91 RAMP3 (0.46) RAMP3CALCRAPLNRIL23RKDM1A
SCHEMBL16340730 0.91 RAMP3 (0.50) RAMP3CALCRAPLNRIL23RKDM1A
SCHEMBL16351203 0.84 RAMP3 (0.48) RAMP3CALCRAPLNRIL23RNMUR2
SCHEMBL12339085 0.78 RAMP3 (0.46) RAMP3CALCRIL23R
SCHEMBL16351204 0.78 RAMP3 (0.46) RAMP3CALCRIL23R
SCHEMBL12314880 0.77 RAMP3 (0.47) RAMP3CALCRIL23R
SCHEMBL12314876 0.77 RAMP3 (0.47) RAMP3CALCRIL23R
SCHEMBL13084700 0.77 RAMP3 (0.47) RAMP3CALCRIL23R
SCHEMBL13084645 0.77 RAMP3 (0.47) RAMP3CALCRIL23R
SCHEMBL16340628 0.76 APLNR (0.42) RAMP3CALCRAPLNRIL23RNMUR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263739-B2 also targeting tumor cells that express vascular endothelial growth factor neuropilin-1 receptor; radiotherapy; radiopharmaceuticals; treating angiogenesis BRACCO SUISSE SA (CH) 2012-09-11 — — US disclosed
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