SCHEMBL21496069

SCHEMBL21496069

C1CCC1.c1ccc2c(c1)-c1ccccc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAOA P21397 4/20 0.50
MAPK1 P28482 3/20 0.50
BCHE P06276 2/20 0.50
MAPT P10636 2/20 0.50
PTPRC P08575 2/20 0.50
NPC1 O15118 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CES1 P23141 2/20 0.50
S100A4 P26447 2/20 0.50
KDM4E B2RXH2 1/20 0.50
CES2 O00748 1/20 0.50
APAF1 O14727 1/20 0.50
TERT O14746 1/20 0.50
PLIN1 O60240 1/20 0.50
TDP2 O95551 1/20 0.50
S1PR4 O95977 1/20 0.50
LMNA P02545 1/20 0.50
PLA2G1B P04054 1/20 0.50

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
SCHEMBL29067593 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL28904690 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL4368339 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL58152 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL49870 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL29437946 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL29543474 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL11875421 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL29711875 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE
SCHEMBL28694051 0.85 MEN1 (0.61) MEN1KMT2AMAOAMAPK1BCHE

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-2019202795-A1 ORGANIC SILICON COMPOUND AND PRODUCTION METHOD THEREFOR 信越化学工業株式会社 2019-10-24 WO disclosed