SCHEMBL10143736

SCHEMBL10143736

CC(C)Oc1ccc(Nc2nc(Cl)cc(N3CCCCC3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ GALR2 O43603 12/20 0.53
▸ GALR1 P47211 2/20 0.48
▸ MAPT P10636 4/20 0.44
▸ POLB P06746 1/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ SLC2A1 P11166 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.42
▸ ALOX15 P16050 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ NR4A1 P22736 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42

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) GALR2GALR1MAPTPOLBSLC2A1
SCHEMBL10143394 0.87 GALR2 (0.67) GALR2GALR1MAPTPOLBSLC2A1
SCHEMBL10143753 0.84 KDM4E (0.55) GALR2GALR1MAPTKDM4ESLC2A1
SCHEMBL10143594 0.78 GALR2 (0.80) GALR2GALR1MAPTPOLB
SCHEMBL10143615 0.77 GALR2 (0.84) GALR2GALR1
SCHEMBL13927340 0.77 GALR2 (0.52) GALR2GALR1MAPTKDM4ESMN1; SMN2
SCHEMBL13927343 0.75 GALR2 (0.50) GALR2GALR1MAPTKDM4ESMN1; SMN2
SCHEMBL10144335 0.75 GALR2 (0.71) GALR2GALR1MAPTMAPK1TDP1
SCHEMBL10143570 0.74 GALR2 (0.53) GALR2GALR1MAPTSLC2A1SMN1; SMN2
SCHEMBL10143742 0.74 JAK2 (0.53) GALR2GALR1MAPTSLC2A1SMN1; SMN2

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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