SCHEMBL14503147

SCHEMBL14503147

FC(F)(F)Oc1cccc(Nc2nc(N3CCCCC3)nc(N3CCCCC3)n2)c1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GALR2 O43603 3/20 0.73
GALR1 P47211 2/20 0.73
MAPT P10636 2/20 0.66
IDH2 P48735 3/20 0.65
CTSL P07711 1/20 0.64
CTSB P07858 1/20 0.64
CTSS P25774 1/20 0.64
CTSK P43235 1/20 0.64
LMNA P02545 3/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
HTT P42858 2/20 0.60
NPSR1 Q6W5P4 1/20 0.59
GBA1 P04062 1/20 0.54
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
ALOX15 P16050 1/20 0.54
TSHR P16473 1/20 0.54
HSD17B10 Q99714 1/20 0.54
ALDH1A1 P00352 1/20 0.52
SYK P43405 1/20 0.51

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
SCHEMBL14503046 0.85 GALR2 (0.55) GALR2GALR1MAPTIDH2CTSL
SCHEMBL10143793 0.85 GALR2 (1.00) GALR2GALR1MAPTIDH2CTSL
SCHEMBL14503014 0.85 GALR2 (0.61) GALR2GALR1MAPTIDH2CTSS
SCHEMBL14505011 0.83 GALR2 (0.55) GALR2GALR1MAPTIDH2CTSL
SCHEMBL5395758 0.81 CTSL (0.55) GALR2GALR1MAPTIDH2CTSL
SCHEMBL10143409 0.79 GALR2 (0.82) GALR2GALR1GBA1KMT2AMEN1
SCHEMBL30568799 0.79 IDH2 (1.00) MAPTIDH2LMNASMN1; SMN2HTT
SCHEMBL14504821 0.78 MAPT (0.56) GALR2GALR1MAPTIDH2CTSS
SCHEMBL10143426 0.77 GALR2 (1.00) GALR2GALR1
SCHEMBL14503558 0.77 LMNA (0.71) MAPTIDH2LMNASMN1; SMN2HTT

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
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-7223759-B2 Antibacterial 3,5-diaminopiperidine-substituted aromatic and heteroaromatic compounds ANADYS PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed