SCHEMBL7946424

SCHEMBL7946424

CCC(C)N(CC=O)C(=O)C(=O)C1CNc2cc(OC)ccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MTNR1A P48039 1/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL7946579 0.73 HDAC8 (0.38) MTNR1AKDM4EALDH1A1
SCHEMBL28981598 0.73 MTNR1A (0.36) MTNR1AKDM4EALDH1A1
SCHEMBL7951889 0.72 KMT2A (0.41) SMN1; SMN2MEN1KMT2AKDM4EALDH1A1
SCHEMBL7948614 0.71 POLB (0.40) KDM4EALDH1A1L3MBTL1
SCHEMBL7982554 0.71 SLC6A9 (0.40)
SCHEMBL7089442 0.71 HSPA1A (0.45) SMN1; SMN2MTNR1AKDM4EALDH1A1
SCHEMBL22864660 0.70 MAPK1 (0.39) MTNR1A
SCHEMBL7947322 0.70 ALDH1A1 (0.40) SMN1; SMN2KDM4EALDH1A1NPSR1L3MBTL1
SCHEMBL7981921 0.70 TSHR (0.40) SMN1; SMN2KDM4ELMNA
SCHEMBL7946077 0.70 POLB (0.35) MEN1KMT2AALDH1A1L3MBTL1

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-2010035032-A1 CALCIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2010-04-01 WO disclosed