SCHEMBL12199834

SCHEMBL12199834

CC(C)(C)c1cc(-c2ccccc2)c(O)c(-n2nc3ccc(Cl)cc3n2)c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
KDM4E B2RXH2 2/20 0.37
CYP1A2 P05177 1/20 0.37
GAA P10253 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
LMNA P02545 2/20 0.35
HTT P42858 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
POLB P06746 1/20 0.34
LTB4R Q15722 2/20 0.34
P2RY6 Q15077 1/20 0.34
AURKA O14965 1/20 0.33
AURKB Q96GD4 1/20 0.33
MAPK1 P28482 1/20 0.33
EGFR P00533 1/20 0.33
RORC P51449 1/20 0.33
CASP3 P42574 1/20 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
SCHEMBL7149442 0.88 NPC1 (0.39) NPC1RAB9AKDM4ECYP1A2GAA
SCHEMBL7149445 0.85 CNR1 (0.39) NPC1RAB9ALTB4R
SCHEMBL12199836 0.84 NPC1 (0.58) NPC1RAB9AKDM4ECYP1A2GAA
SCHEMBL20600538 0.84 RXRA (0.47)
SCHEMBL7901461 0.83 NPC1 (0.41) NPC1RAB9AKDM4ECYP1A2GAA
SCHEMBL7523685 0.83 NPC1 (0.41) NPC1RAB9AKDM4ECYP1A2GAA
SCHEMBL5809113 0.83 NPC1 (0.45) NPC1RAB9AKDM4ELMNAPOLB
SCHEMBL29814540 0.83 NPC1 (0.45) NPC1RAB9AKDM4ELMNAPOLB
Toluene SCHEMBL29114789 0.82 NPC1 (0.46) NPC1RAB9AKDM4ECYP1A2GAA
SCHEMBL29349567 0.82 NPC1 (0.41) NPC1RAB9AKDM4ECYP1A2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034878-B2 Low molecular weight ethylene interpolymers, methods of making, and uses thereof DOW GLOBAL TECHNOLOGIES LLC (US) 2011-10-11 US disclosed
US-8034878-B2 Low molecular weight ethylene interpolymers, methods of making, and uses thereof DOW GLOBAL TECHNOLOGIES LLC (US) 2011-10-11 US disclosed
US-20080306217-A1 Low Molecular Weight Ethylene Interpolymers, Methods of Making, and Uses Thereof DOW GLOBAL TECHNOLOGIES LLC 2008-12-11 US disclosed
US-20080306217-A1 Low Molecular Weight Ethylene Interpolymers, Methods of Making, and Uses Thereof DOW GLOBAL TECHNOLOGIES LLC 2008-12-11 US disclosed
US-7259219-B2 Low molecular weight copolymer of ethylene and vinyl aromatic monomer and uses thereof DOW GLOBAL TECHNOLOGIES INC. (US) 2007-08-21 US disclosed
US-7259219-B2 Low molecular weight copolymer of ethylene and vinyl aromatic monomer and uses thereof DOW GLOBAL TECHNOLOGIES INC. (US) 2007-08-21 US disclosed
WO-2007078697-A1 LOW MOLECULAR WEIGHT ETHYLENE INTERPOLYMERS, METHODS OF MAKING, AND USES THEREOF DOW GLOBAL TECHNOLOGIES INC. (US) 2007-07-12 WO disclosed