SCHEMBL4159466

SCHEMBL4159466

CN1CC=C(c2ccccc2N)CC1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.54
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.54
HTR1A P08908 1/20 0.54
ALOX15 P16050 1/20 0.54
SLC6A4 P31645 1/20 0.54
HTR6 P50406 1/20 0.54
HSD17B10 Q99714 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
DRD2 P14416 8/20 0.54
DRD4 P21917 8/20 0.54
QDPR P09417 1/20 0.49

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
Hydrochloric Acid SCHEMBL2263936 0.81 KDM4E (0.55) KDM4ELMNAPOLBHTR1AALOX15
SCHEMBL1078756 0.81 KDM4E (0.55) KDM4ELMNAPOLBHTR1AALOX15
SCHEMBL29387382 0.81 KDM4E (0.55) KDM4ELMNAPOLBHTR1AALOX15
SCHEMBL29974417 0.80 QDPR (0.46) KDM4ELMNAPOLBHTR1AALOX15
SCHEMBL83106 0.79 ALDH1A1 (0.40) KDM4ELMNAPOLBHTR1AALOX15
Hydrochloric Acid SCHEMBL27897014 0.79 DRD2 (0.50) KDM4ELMNAPOLBHTR1AALOX15
Hydrochloric Acid SCHEMBL1148906 0.78 QDPR (0.65) KDM4ELMNAPOLBHTR1AALOX15
SCHEMBL24136831 0.78 SLC6A4 (0.58) SLC6A4DRD2
SCHEMBL10917066 0.78 SLC6A4 (0.58) SLC6A4HTR6DRD2DRD4QDPR
SCHEMBL7255363 0.77 HTR6 (0.58) KDM4ELMNAPOLBHTR1AALOX15

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8512678-B2 Non-invasive, in vivo fluorescent imaging of the nervous system in whole living animal AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2013-08-20 US disclosed
US-20090106851-A1 Non-Invasive, In Vivo Fluorescent Imaging of the Nervous System In Whole Living Animal AGENCY FOR SCIENCE TECHNOLOGY AND RESEARCH (SG) 2009-04-23 US disclosed
EP-1945024-A4 IN VIVO FLUORESCENCE IMAGING AGENCY SCIENCE TECH & RES (SG) 2008-12-17 EP disclosed
EP-1945024-A1 IN VIVO FLUORESCENCE IMAGING Agency for Science, Technology and Research (SG) 2008-07-23 EP disclosed
WO-2007046774-A1 IN VIVO FLUORESCENCE IMAGING AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2007-04-26 WO disclosed