SCHEMBL20034969

SCHEMBL20034969

CCCCCCC(=O)N1CC[C@@H](C)C1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.71
KMT2A Q03164 2/20 0.71
POLB P06746 2/20 0.71
MAPT P10636 1/20 0.71
GNAI3 P08754 9/20 0.62
GNAI1 P63096 9/20 0.62
GNAO1 P09471 8/20 0.62
NPC1 O15118 1/20 0.61
L3MBTL1 Q9Y468 2/20 0.56
TDP1 Q9NUW8 1/20 0.54
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46

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
SCHEMBL3663914 0.93 MEN1 (0.81) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL7533923 0.90 MEN1 (0.88) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL14879717 0.90 MEN1 (0.88) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL8423209 0.90 MEN1 (0.88) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL3365303 0.90 NPC1 (0.76) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL14879738 0.90 NPC1 (0.76) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL25934640 0.88 NPC1 (0.79) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL10274495 0.86 MEN1 (0.65) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL19528315 0.86 MEN1 (0.65) MEN1KMT2APOLBMAPTGNAI3
SCHEMBL17739977 0.85 NPC1 (0.59) MEN1KMT2APOLBMAPTGNAI3

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
US-9938323-B2 Amatoxin derivatives and conjugates thereof as inhibitors of RNA polymerase NOVARTIS AG (CH) 2018-04-10 US disclosed