SCHEMBL11633600

SCHEMBL11633600

CCCNC1=NCC(C23CC4CC(CC(C4)C2)C3)O1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL11635870 0.80 GRIN2D (0.32)
SCHEMBL11633724 0.76 MAPT (0.32)
SCHEMBL11636742 0.71 MEN1 (0.33) MEN1KMT2AL3MBTL1
SCHEMBL11638397 0.67 GRIN2D (0.31) MEN1KMT2A
SCHEMBL17887829 0.65 KDM4E (0.33)
SCHEMBL60897 0.56 GRIN2D (0.48) MEN1KMT2AL3MBTL1
SCHEMBL6236793 0.56
SCHEMBL11125378 0.56
SCHEMBL7403616 0.54 GRIN2D (0.36) MEN1KMT2A
SCHEMBL7401855 0.54 GRIN2D (0.36) MEN1KMT2A

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-4100170-A ANTIHYPERTENSIVE AGENTS, MONOAMINE OXIDASE INHIBITORS PENNWALT CORPORATION (US) 1978-07-11 US disclosed