SCHEMBL3632093

SCHEMBL3632093

COc1ccc(Cl)cc1C(=N)NC#N

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
KCNMA1 Q12791 4/20 0.45
ALDH1A1 P00352 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 3/20 0.41
NPC1 O15118 2/20 0.41
DNMT3A Q9Y6K1 1/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
KLF5 Q13887 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
KDM4E B2RXH2 1/20 0.40

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
SCHEMBL19378588 0.81 LMNA (0.53) LMNAKCNMA1ALDH1A1L3MBTL1MEN1
SCHEMBL3631756 0.78 PTPN7 (0.40) ALDH1A1L3MBTL1MAPTRAB9AKDM4E
SCHEMBL3629922 0.78 LMNA (0.46) LMNAL3MBTL1MEN1KMT2ANPC1
SCHEMBL3629401 0.75 ALDH1A1 (0.36) ALDH1A1L3MBTL1KMT2AMAPTNPC1
SCHEMBL3911579 0.74 MAPT (0.52) LMNAKCNMA1ALDH1A1L3MBTL1MEN1
SCHEMBL11306685 0.73 LMNA (0.63) LMNAKCNMA1ALDH1A1L3MBTL1MEN1
Iodide SCHEMBL6759686 0.72 LMNA (0.50) LMNAKCNMA1ALDH1A1L3MBTL1MEN1
Hydrochloric Acid SCHEMBL18920731 0.72 MAPT (0.51) LMNAKCNMA1ALDH1A1MEN1KMT2A
SCHEMBL12127346 0.71 LMNA (0.53) LMNAKCNMA1ALDH1A1L3MBTL1MEN1
SCHEMBL16951330 0.71 LMNA (0.56) LMNAKCNMA1ALDH1A1L3MBTL1MEN1

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