SCHEMBL6903006

SCHEMBL6903006

CC1=C(N2CCCC2)c2ccccc2C1[Si](C)(C)NC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APAF1 O14727 5/20 0.36
NPC1 O15118 3/20 0.36
RAB9A P51151 3/20 0.36
SMN1; SMN2 Q16637 5/20 0.34
ALDH1A1 P00352 4/20 0.34
MAPT P10636 4/20 0.34
HTT P42858 3/20 0.34
POLB P06746 2/20 0.34
MITF O75030 1/20 0.34
LMNA P02545 1/20 0.34
KLF5 Q13887 1/20 0.34
PTBP1 P26599 1/20 0.32
MAPK1 P28482 1/20 0.32
GAA P10253 2/20 0.31
CDC25A P30304 1/20 0.31
CDC25B P30305 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.30
KDM4E B2RXH2 1/20 0.30
HPGD P15428 1/20 0.30
MEN1 O00255 2/20 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
SCHEMBL6910553 0.86 APAF1 (0.33) APAF1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL6904356 0.85 MAPT (0.35) APAF1NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL7630038 0.83
Hydrochloric Acid SCHEMBL8022568 0.81 GAA (0.30) GAA
SCHEMBL6903828 0.79
SCHEMBL7510367 0.75 GPR3 (0.36) POLBLMNAMEN1KMT2A
SCHEMBL8283386 0.75 DRD2 (0.31)
SCHEMBL540904 0.74 GPR3 (0.35) POLBMEN1KMT2A
Hydrochloric Acid SCHEMBL6852852 0.73
Hydrochloric Acid SCHEMBL6852848 0.73

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