SCHEMBL6470599

SCHEMBL6470599

CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)ccc1C2[Si](C)(C)Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
PLA2G1B P04054 1/20 0.38
NFKB1 P19838 1/20 0.38
CASP3 P42574 1/20 0.38
NFKB2 Q00653 1/20 0.38
RELA Q04206 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ATG4B Q9Y4P1 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
KIF11 P52732 2/20 0.33

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
SCHEMBL6435462 0.85 ALDH1A1 (0.38) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL28556575 0.85 ALDH1A1 (0.40) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL6472439 0.77 ALDH1A1 (0.35) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL7676358 0.75 CYP1A2 (0.36) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL18261205 0.74 ALDH1A1 (0.44) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL945915 0.74 ALDH1A1 (0.44) ALDH1A1NPC1RAB9APLA2G1BNFKB1
Hydrochloric Acid SCHEMBL6526808 0.74 CYP1A2 (0.35) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL1452217 0.73 ALDH1A1 (0.35) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL6471561 0.72 ALDH1A1 (0.42) ALDH1A1NPC1RAB9APLA2G1BNFKB1
SCHEMBL540391 0.72 ALDH1A1 (0.47) ALDH1A1NPC1RAB9APLA2G1BNFKB1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6894132-B2 Polyolefin production ATOFINA RESEARCH S.A. (BE) 2005-05-17 US disclosed
US-20040087746-A1 Polyolefin production RAZAVI ABBAS (BE) 2004-05-06 US disclosed
US-6630550-B1 Olefin monomers polymerised using these catalysts to form syndiotactic/atactic block polymers of high molecular weight and comprising at least 70% of syndiotactic triads. FINA RESEARCH, S.A. (BE) 2003-10-07 US disclosed
EP-1224228-A1 POLYOLEFIN PRODUCTION ATOFINA Research (BE) 2002-07-24 EP disclosed
WO-2001019877-A1 POLYOLEFIN PRODUCTION ATOFINA RESEARCH (BE) 2001-03-22 WO disclosed
EP-1083188-A1 Catalyst and process for the preparation of syndiotactic / atactic block polyolefins FINA RESEARCH S.A. (BE) 2001-03-14 EP disclosed