SCHEMBL6904356

SCHEMBL6904356

[Li]C1=C(N2CCCCC2)c2ccccc2C1[Si](C)(C)NC(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.35
APAF1 O14727 5/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
ALDH1A1 P00352 4/20 0.35
HTT P42858 4/20 0.35
NPC1 O15118 3/20 0.35
LMNA P02545 2/20 0.35
POLB P06746 2/20 0.35
MITF O75030 1/20 0.35
KLF5 Q13887 1/20 0.35
RAB9A P51151 3/20 0.35
MAPK1 P28482 2/20 0.33
PTBP1 P26599 1/20 0.33
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
MEN1 O00255 3/20 0.31
KMT2A Q03164 3/20 0.31
NPSR1 Q6W5P4 2/20 0.31
NSD2 O96028 2/20 0.31
GAA P10253 2/20 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
SCHEMBL6910553 0.99 APAF1 (0.33) MAPTAPAF1SMN1; SMN2ALDH1A1HTT
SCHEMBL6903006 0.85 APAF1 (0.36) MAPTAPAF1SMN1; SMN2ALDH1A1HTT
SCHEMBL6911052 0.82 BCHE (0.37) MAPTAPAF1SMN1; SMN2ALDH1A1HTT
SCHEMBL6908964 0.79 HTT (0.36) MAPTAPAF1SMN1; SMN2ALDH1A1HTT
SCHEMBL7949111 0.78 HTT (0.35) MAPTAPAF1SMN1; SMN2ALDH1A1HTT
SCHEMBL6908346 0.74 ALDH1A1 (0.31) ALDH1A1NPSR1
SCHEMBL7510367 0.73 GPR3 (0.36) LMNAPOLBMEN1KMT2A
SCHEMBL6909662 0.73 GPR3 (0.31)
SCHEMBL6907620 0.72 TSHR (0.35) MAPTAPAF1SMN1; SMN2ALDH1A1HTT
SCHEMBL540904 0.72 GPR3 (0.35) POLBMEN1KMT2A

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-0923589-B1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-15 EP disclosed
US-6268444-B1 TITANIUM, ZIRCONIUM OR HAFNIUM COMPOUNDS FOR POLYMERIZATION DOW CHEMICAL COMPANY 2001-07-31 US disclosed