SCHEMBL13716397

SCHEMBL13716397

CC1CN(c2ccc(NCO)cc2)CC(C)O1

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.63
LRRK2 Q5S007 7/20 0.46
TSHR P16473 1/20 0.41
RAB9A P51151 1/20 0.40
KMT2A Q03164 2/20 0.40
POLB P06746 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
SCHEMBL18436160 0.82 MAPT (0.57) MAPTLRRK2RAB9APOLB
SCHEMBL17128163 0.80 MAPT (0.58) MAPTLRRK2RAB9AKMT2APOLB
SCHEMBL18436424 0.80 MAPT (0.58) MAPTLRRK2RAB9AKMT2APOLB
SCHEMBL13105197 0.80 MAPT (0.66) MAPTLRRK2TSHRRAB9AKMT2A
SCHEMBL13105222 0.80 MAPT (0.66) MAPTLRRK2TSHRRAB9AKMT2A
SCHEMBL29531915 0.77 MAPT (1.00) MAPTRAB9APOLB
SCHEMBL18436159 0.77 MAPT (0.51) MAPTLRRK2RAB9AKMT2A
SCHEMBL11934800 0.77 MAPT (0.51) MAPTLRRK2RAB9A
SCHEMBL11935563 0.77 MAPT (0.51) MAPTLRRK2RAB9A
SCHEMBL13438677 0.77 MAPT (0.51) MAPTLRRK2RAB9A

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-1249233-B9 NPYY5 ANTAGONISTS SHIONOGI & CO (JP) 2009-08-05 EP disclosed
EP-1249233-B1 NPYY5 ANTAGONISTS SHIONOGI & CO (JP) 2008-08-20 EP disclosed