SCHEMBL10143742

SCHEMBL10143742

COc1ccc(Nc2nc(Cl)cc(N3CCS(=O)(=O)CC3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ JAK2 O60674 2/20 0.53
▸ JAK3 P52333 2/20 0.53
▸ GALR2 O43603 12/20 0.52
▸ AURKA O14965 1/20 0.49
▸ MAPT P10636 2/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ SLC2A1 P11166 1/20 0.48
▸ GALR1 P47211 2/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ PTK2 Q05397 1/20 0.45
▸ PTGS2 P35354 1/20 0.44

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
SCHEMBL10143394 0.86 GALR2 (0.67) GALR2MAPTSMN1; SMN2SLC2A1GALR1
SCHEMBL10143551 0.86 GALR2 (0.67) GALR2MAPTSMN1; SMN2SLC2A1GALR1
SCHEMBL10143570 0.83 GALR2 (0.53) GALR2AURKAMAPTSMN1; SMN2SLC2A1
SCHEMBL10143440 0.81 KMT2A (0.54) GALR2AURKAMAPTSMN1; SMN2MEN1
SCHEMBL10143625 0.79 GALR2 (0.79) GALR2AURKAGALR1
SCHEMBL10143741 0.79 GALR2 (0.79) JAK2JAK3GALR2AURKASLC2A1
SCHEMBL10143436 0.78 GALR2 (0.64) JAK2JAK3GALR2AURKAMAPT
SCHEMBL10144220 0.77 GALR2 (0.66) GALR2MAPTSMN1; SMN2SLC2A1GALR1
SCHEMBL10143457 0.76 MAPT (0.61) GALR2MAPTSMN1; SMN2SLC2A1GALR1
SCHEMBL10143753 0.74 KDM4E (0.55) JAK2GALR2MAPTSMN1; SMN2SLC2A1

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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