SCHEMBL19953582

SCHEMBL19953582

CN1C(=O)CC(C)(C(=O)NC2Cc3ccccc3C2)c2cc(F)ccc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRM7 Q14831 1/20 0.41
PTGDR2 Q9Y5Y4 3/20 0.38
THRB P10828 1/20 0.38
TRPV1 Q8NER1 8/20 0.38
PYGL P06737 1/20 0.38
PYGM P11217 1/20 0.38
CHRNA7 P36544 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
NPC1 O15118 1/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34
HSD17B3 P37058 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
SCHEMBL19953542 0.92 GRM7 (0.41) GRM7PTGDR2THRBTRPV1PYGL
SCHEMBL19960700 0.73 GRM7 (0.43) GRM7TRPV1PYGLPYGMCHRNA7
SCHEMBL19953484 0.71 GRM7 (0.43) GRM7TRPV1PYGLPYGMCHRNA7
SCHEMBL19960705 0.67 PRMT5 (0.34) GRM7TRPV1
SCHEMBL19953508 0.66 HRH3 (0.46) GRM7NPC1LMNARAB9A
SCHEMBL19960571 0.64 GRM7 (0.39) GRM7MEN1KMT2ANPC1LMNA
SCHEMBL31637765 0.63 CA1 (0.61) GRM7
SCHEMBL19953537 0.63 GRM7 (0.39) GRM7TRPV1PYGLPYGMMEN1
SCHEMBL19960710 0.62 GRM7 (0.41) GRM7PYGLPYGMCHRNA7MEN1
SCHEMBL19953584 0.62 FABP5 (0.43) GRM7MEN1KMT2ANPC1LMNA

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-2018047983-A1 INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-03-15 WO disclosed