SCHEMBL5336879

SCHEMBL5336879

C#Cc1c(NC(=NC(=O)OC(C)(C)C)NC(=O)OC(C)(C)C)cccc1[Si](C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
NR1H4 Q96RI1 1/20 0.32
BRD9 Q9H8M2 1/20 0.31
RAB9A P51151 1/20 0.31
RXFP1 Q9HBX9 1/20 0.30
METAP1 P53582 1/20 0.30

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
SCHEMBL5339653 0.80 LMNA (0.39) LMNAPOLBBRD9RAB9ARXFP1
SCHEMBL29931186 0.75 GAA (0.41) LMNAPOLBBRD9RAB9A
SCHEMBL8886501 0.75 HTT (0.43) LMNAPOLBBRD9RAB9A
SCHEMBL20315227 0.74 RAB9A (0.45) LMNAPOLBBRD9RAB9A
SCHEMBL5339650 0.73 PTPN11 (0.42) NR1H4
SCHEMBL4848584 0.72 TRPV1 (0.50)
SCHEMBL14018973 0.72 TRPV1 (0.50)
SCHEMBL4848588 0.72 TRPV1 (0.50)
SCHEMBL3799518 0.71 MAPT (0.33) POLBRAB9A
SCHEMBL17902833 0.71 ALDH1A1 (0.47) LMNAPOLB

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-1824468-A2 GLYCOGEN SYNTHASE KINASE-3 INHIBITORS Tel Aviv University Future Technology Development L.P. (IL) 2007-08-29 EP disclosed
WO-2006054298-A2 GLYCOGEN SYNTHASE KINASE-3 INHIBITORS TEL AVIV UNIVERSITY FUTURE TECHNOLOGY DEVELOPMENT L.P. (IL) 2006-05-26 WO disclosed