SCHEMBL8715764

SCHEMBL8715764

CNC(=O)C(Cc1cccs1)N(C)C(=O)C(COCc1ccccc1)NC(=O)c1cccc(CCN)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
KLKB1 P03952 1/20 0.38
KLK1 P06870 1/20 0.38
CTSB P07858 3/20 0.37
CTSS P25774 3/20 0.36
GPR132 Q9UNW8 2/20 0.36
USP30 Q70CQ3 1/20 0.35
HPGDS O60760 2/20 0.35
ALDH1A1 P00352 1/20 0.35
CTSL P07711 2/20 0.34
MMP1 P03956 1/20 0.34
MMP3 P08254 1/20 0.34
ADAM17 P78536 1/20 0.34
CTSC P53634 1/20 0.34
PYGL P06737 1/20 0.34

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
SCHEMBL6320315 0.83 TRPM8 (0.35) KLKB1KLK1CTSBCTSSCTSL
SCHEMBL6325998 0.79 ADAM17 (0.36) NPC1LMNAHPGDRAB9ACTSS
SCHEMBL8206197 0.75 RAB9A (0.38) NPC1LMNARAB9AKLKB1KLK1
SCHEMBL6324203 0.74 GHSR (0.35) LMNACTSSMMP1MMP3ADAM17
SCHEMBL6318955 0.74 CTSC (0.35) LMNAKLKB1KLK1CTSSMMP1
SCHEMBL6324114 0.74 LOXL2 (0.39) KLKB1KLK1CTSBCTSSCTSL
SCHEMBL6317903 0.73 GHSR (0.44) KLKB1KLK1HPGDSALDH1A1ADAM17
SCHEMBL6318111 0.73 GHSR (0.53) CTSBCTSSADAM17CTSC
SCHEMBL6318119 0.73 GHSR (0.53) CTSBCTSSADAM17CTSC
SCHEMBL8525046 0.72 CTSL (0.51) KLKB1KLK1CTSSCTSLMMP1

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
EP-0869974-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1998-10-14 EP claimed