SCHEMBL7594289

SCHEMBL7594289

O=C(c1cc[nH]c1)c1cc2c3c(ccc2[nH]1)N(C(=O)c1cc2c4c(ccc2[nH]1)NCC4)CC3

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 11/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
POLB P06746 1/20 0.33
PLK4 O00444 1/20 0.32
DAPK3 O43293 1/20 0.32
DYRK3 O43781 1/20 0.32
JAK2 O60674 1/20 0.32
PRKD3 O94806 1/20 0.32
MAP4K4 O95819 1/20 0.32
PIM1 P11309 1/20 0.32
RPS6KB1 P23443 1/20 0.32
CDK2 P24941 1/20 0.32
MAPK1 P28482 1/20 0.32
KDR P35968 1/20 0.32
MAPK8 P45983 1/20 0.32
CLK2 P49760 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
SCHEMBL5384431 0.85 NPC1 (0.38) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL532721 0.85 NPC1 (0.38) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL29462567 0.84 NPC1 (0.36) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL22048825 0.84 RAB9A (0.38) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL20764391 0.83 NPC1 (0.35) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL22062300 0.83 PLK4 (0.38) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL5388939 0.82 RAB9A (0.41) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL22871731 0.81 PLK4 (0.38) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL20195671 0.78 NPC1 (0.39) HRH4NPC1RAB9AMEN1KMT2A
SCHEMBL532241 0.72 MAPT (0.38) HRH4MEN1KMT2APLK4DAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235938-A2 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS Epoch Biosciences, Inc. (US) 2002-09-04 EP disclosed
WO-2001042505-A2 FLUORESCENT QUENCHING DETECTION REAGENTS AND METHODS EPOCH BIOSCIENCES, INC. (US) 2001-06-14 WO disclosed