SCHEMBL3632085

SCHEMBL3632085

COc1ccc(Cl)cc1/C(N)=N/C#N

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.52
KDM4E B2RXH2 1/20 0.46
NPC1 O15118 2/20 0.45
POLB P06746 1/20 0.45
HTR3E A5X5Y0 1/20 0.44
HTR3B O95264 1/20 0.44
HTR3A P46098 1/20 0.44
HTR3D Q70Z44 1/20 0.44
HTR3C Q8WXA8 1/20 0.44
LMNA P02545 1/20 0.44
KCNMA1 Q12791 3/20 0.42
ALDH1A1 P00352 2/20 0.42
AR P10275 1/20 0.41
SLC9A1 P19634 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
MAPK1 P28482 1/20 0.40
TSHR P16473 1/20 0.39

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
SCHEMBL3632088 1.00 MAPT (0.52) MAPTKDM4ENPC1POLBHTR3E
SCHEMBL19681391 0.81 MAPT (0.57) MAPTNPC1POLBHTR3EHTR3B
SCHEMBL17041328 0.81 MAPT (0.57) MAPTNPC1POLBHTR3EHTR3B
SCHEMBL29520009 0.81 MAPT (0.57) MAPTNPC1POLBHTR3EHTR3B
SCHEMBL3631753 0.78 L3MBTL1 (0.40) MAPTARMEN1KMT2AMAPK1
SCHEMBL3631751 0.78 L3MBTL1 (0.40) MAPTARMEN1KMT2AMAPK1
SCHEMBL3629916 0.78 POLB (0.50) MAPTNPC1POLBLMNAALDH1A1
SCHEMBL3629919 0.78 POLB (0.50) MAPTNPC1POLBLMNAALDH1A1
SCHEMBL943697 0.77 MEN1 (0.47) MAPTKDM4ENPC1LMNAKCNMA1
SCHEMBL3629402 0.76 KDM4E (0.37) MAPTKDM4ENPC1POLBALDH1A1

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-2142522-A1 1, 3-THIAZOL-2 (3H) -YLIDENE COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS Abbott Laboratories (US) 2010-01-13 EP claimed
WO-2008121558-A1 1, 3-THIAZOL-2 (3H) -YLIDENE COMPOUNDS AS CANNABINOID RECEPTOR LIGANDS ABBOTT LABORATORIES (US) 2008-10-09 WO claimed