SCHEMBL5269397

SCHEMBL5269397

Cc1ccc(-c2nc3ccc(Sc4ccccc4)nn3c2CNC(=O)OCC(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.36
RXFP1 Q9HBX9 2/20 0.36
ALDH1A1 P00352 5/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 3/20 0.36
TSHR P16473 2/20 0.36
POLB P06746 2/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
ALOX15 P16050 1/20 0.36
MCL1 Q07820 1/20 0.36
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
NOTUM Q6P988 2/20 0.35
SLC2A2 P11168 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HDAC1 Q13547 1/20 0.35
KCNK3 O14649 1/20 0.34
KCNK9 Q9NPC2 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
SCHEMBL5273186 0.91 NPC1 (0.42) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5269602 0.90 KDM4E (0.37) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5272192 0.89 KDM4E (0.41) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5267665 0.89 MAPK1 (0.39) NPC1RAB9ALMNAMAPK1SLC2A2
SCHEMBL5269079 0.88 KDM4E (0.38) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5271977 0.87 FAAH (0.40) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5271030 0.87 FAAH (0.38) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5269620 0.86 KDM4E (0.38) KDM4ERXFP1ALDH1A1HPGDHSD17B10
SCHEMBL5269494 0.84 NR1H4 (0.41) KDM4EALDH1A1HSD17B10NPC1RAB9A
SCHEMBL5272481 0.84 LMNA (0.37) KDM4EALDH1A1HPGDHSD17B10TSHR

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
EP-1845098-A1 Imidazo[1,2-b]pyridazines, their processes of preparation and their use as GABA receptor ligands FERRER INTERNACIONAL, S.A. (ES) 2007-10-17 EP claimed
EP-1845098-A1 Imidazo[1,2-b]pyridazines, their processes of preparation and their use as GABA receptor ligands FERRER INTERNACIONAL, S.A. (ES) 2007-10-17 EP disclosed