SCHEMBL3784063

SCHEMBL3784063

PCCCCCCCC(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 14/20 0.57
KCNH2 Q12809 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP11B1 P15538 1/20 0.37
CYP11B2 P19099 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
CYP1A2 P05177 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 1/20 0.34
CHRM3 P20309 1/20 0.34

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
SCHEMBL4626248 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
SCHEMBL6647653 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
SCHEMBL2945852 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
SCHEMBL6649594 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
SCHEMBL6653059 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
SCHEMBL29032108 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
SCHEMBL29032106 1.00 KIF11 (0.57) KIF11KCNH2CYP2C9CYP2C19CYP3A4
Iodide SCHEMBL5091824 0.98 KIF11 (0.55) KIF11KCNH2CYP2C9CYP2C19CYP3A4
Hydrochloric Acid SCHEMBL5087281 0.98 KIF11 (0.55) KIF11KCNH2CYP2C9CYP2C19CYP3A4
Bromide SCHEMBL10797449 0.98 KIF11 (0.55) KIF11KCNH2CYP2C9CYP2C19CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10571772-B2 Added feature electrooptical devices and automotive components AJJER, LLC (US) 2020-02-25 US disclosed
US-20130128333-A1 Added feature electrooptical devices and automotive components AJJER LLC (US) 2013-05-23 US disclosed
CN-101679292-B Ionic liquid and method for producing the same NIPPON CHEMICALS 2012-11-14 CN disclosed
US-20100291374-A1 Composites Comprising Nanoparticles AJJER LLC (US) 2010-11-18 US disclosed
CN-101679292-A Ionic liquid and method for producing the same NIPPOH CHEMICALS (JP) 2010-03-24 CN disclosed