SCHEMBL6447997

SCHEMBL6447997

C/C=C(/C)c1ccc(OC)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.58
MKNK1 Q9BUB5 1/20 0.47
MKNK2 Q9HBH9 1/20 0.47
GPR183 P32249 2/20 0.46
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CYP2A6 P11509 2/20 0.40
MAPT P10636 2/20 0.40
OXTR P30559 1/20 0.39
HSD17B1 P14061 1/20 0.39
HSD17B2 P37059 1/20 0.39
TUBB4A P04350 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 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
SCHEMBL31503107 0.85 NNMT (0.54) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL3034304 0.85 NNMT (0.54) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL25658653 0.85 NNMT (0.59) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL3034306 0.85 NNMT (0.54) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL1515192 0.82 NNMT (0.63) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL34467320 0.81 NNMT (0.58) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL34467450 0.80 NNMT (0.57) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL25477772 0.78 NNMT (0.59) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL105066 0.78 NNMT (0.70) NNMTMKNK1MKNK2GPR183MAOA
SCHEMBL18228074 0.76 NNMT (0.72) NNMTMKNK1MKNK2GPR183MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012065062-A1 NOVEL ANTIVIRAL COMPOUNDS PHARMARESOURCES(SHANGHAI)CO., LTD. (CN) 2012-05-18 WO disclosed