SCHEMBL4117461

SCHEMBL4117461

c1ccc(-c2cnnc(N3CCN(c4ncccn4)CC3)c2-c2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 1/20 0.50
MAPK14 Q16539 1/20 0.50
MAPT P10636 4/20 0.47
LMNA P02545 2/20 0.47
SLC6A7 Q99884 3/20 0.47
ALDH1A1 P00352 7/20 0.45
TSHR P16473 3/20 0.45
KDM4E B2RXH2 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
MAPK1 P28482 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
HTR1A P08908 2/20 0.42
DRD2 P14416 1/20 0.42
DRD4 P21917 1/20 0.42
HTR3A P46098 1/20 0.42
HTT P42858 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CREBBP Q92793 1/20 0.41

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
SCHEMBL1752967 0.81 SLC6A7 (0.53) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL27705074 0.79 SLC6A7 (0.51) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL12706599 0.76 CSNK1D (0.54) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL720267 0.74 SLC6A7 (0.56) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL29572108 0.74 SLC6A7 (0.56) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL1753162 0.72 SLC6A7 (0.50) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL1753129 0.72 SLC6A7 (0.50) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL1753150 0.71 CSNK1D (0.52) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL1753096 0.70 CSNK1D (0.54) CSNK1DMAPK14MAPTLMNASLC6A7
SCHEMBL1753210 0.70 MAPT (0.49) CSNK1DMAPK14MAPTLMNASLC6A7

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-2063894-A2 FORMULATIONS CONTAINING PYRIDAZINE COMPOUNDS FOR TREATING NEUROINFLAMMATORY DISEASES The Regents Of Northwestern University (US) 2009-06-03 EP disclosed
WO-2007127375-A2 FORMULATIONS CONTAINING PYRIDAZINE COMPOUNDS FOR TREATING NEUROINFLAMMATORY DISEASES NORTHWESTERN UNIVERSITY (US) 2007-11-08 WO disclosed