SCHEMBL10143753

SCHEMBL10143753

CCOc1ccc(Nc2nc(Cl)cc(N3CCCCC3)n2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.55
▸ NFKB1 P19838 1/20 0.55
▸ MAPT P10636 6/20 0.54
▸ GALR2 O43603 9/20 0.53
▸ HTT P42858 2/20 0.51
▸ NPC1 O15118 1/20 0.51
▸ JAK2 O60674 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ MEN1 O00255 1/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ GALR1 P47211 1/20 0.48
▸ SYK P43405 1/20 0.47
▸ SLC2A1 P11166 1/20 0.46

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
SCHEMBL10143551 0.87 GALR2 (0.67) MAPTGALR2HTTMEN1MAPK1
SCHEMBL10143394 0.87 GALR2 (0.67) MAPTGALR2HTTMEN1MAPK1
SCHEMBL10143736 0.84 GALR2 (0.53) KDM4EMAPTGALR2MEN1MAPK1
SCHEMBL10143621 0.78 GALR2 (0.80) MAPTGALR2GALR1
SCHEMBL655538 0.77 SYK (0.68) KDM4ENFKB1MAPTHTTNPC1
SCHEMBL10143747 0.77 GALR2 (0.84) GALR2GALR1
SCHEMBL13763849 0.75 GALR2 (0.50) KDM4EMAPTGALR2MEN1MAPK1
SCHEMBL10144335 0.75 GALR2 (0.71) MAPTGALR2HTTMAPK1TDP1
SCHEMBL21313483 0.75 MAPT (0.50) MAPTMEN1MAPK1KMT2ASMN1; SMN2
SCHEMBL10143570 0.74 GALR2 (0.53) MAPTGALR2MEN1MAPK1KMT2A

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-2012009258-A2 PEPTIDOMIMETIC GALANIN RECEPTOR MODULATORS ROBERTS EDWARD (US) 2012-01-19 — — WO disclosed
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