SCHEMBL20622707

SCHEMBL20622707

CCCCCCCCCC(=O)N[C@@H](Cc1cn(C)c2ccccc12)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.57
▸ HPGD P15428 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ FAAH O00519 2/20 0.53
▸ MEN1 O00255 2/20 0.50
▸ KMT2A Q03164 2/20 0.50
▸ ADAM17 P78536 2/20 0.46
▸ EPHA2 P29317 1/20 0.46
▸ MMP9 P14780 1/20 0.46
▸ MMP8 P22894 1/20 0.46
▸ NOD1 Q9Y239 1/20 0.46
▸ ITGB3 P05106 1/20 0.46
▸ ITGA2B P08514 1/20 0.46
▸ FNTA P49354 1/20 0.46
▸ FNTB P49356 1/20 0.46
▸ CDC25A P30304 1/20 0.46
▸ LMNA P02545 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ RXFP1 Q9HBX9 1/20 0.45

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
SCHEMBL8242416 1.00 KDM4E (0.57) KDM4EHPGDHSD17B10FAAHMEN1
SCHEMBL11032123 0.94 FAAH (0.61) KDM4EHPGDHSD17B10FAAHMEN1
SCHEMBL8242399 0.89 KDM4E (0.55) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL11486027 0.85 KDM4E (0.55) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL11486031 0.85 KDM4E (0.55) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL15143004 0.84 KMT2A (0.66) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL8236092 0.84 KDM4E (0.50) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL8244975 0.84 KDM4E (0.56) KDM4EHPGDHSD17B10MEN1KMT2A
SCHEMBL16366280 0.84 KDM4E (0.52) KDM4EHPGDHSD17B10FAAHMEN1
SCHEMBL23677942 0.83 ADAM17 (0.52) KDM4EHPGDHSD17B10MEN1KMT2A

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
WO-2019005617-A1 ANTIBACTERIAL LIPOPEPTIDES AND METHODS FOR THEIR PREPARATION AND USE Ramapo Pharmaceuticals, Inc. (US) 2019-01-03 — — WO disclosed
Send feedback