SCHEMBL7130806

SCHEMBL7130806

CC1=Cc2c(-c3ccc(C(F)(F)F)cc3)cccc2C1[Zr](C)(C)([SiH3])(Cl)(Cl)C1C(C)=Cc2c(-c3ccc(C(F)(F)F)cc3)cccc21

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.35
CYP11B1 P15538 1/20 0.34
CYP11B2 P19099 1/20 0.34
ENPP1 P22413 1/20 0.32
DRD2 P14416 1/20 0.32
JAK2 O60674 1/20 0.32
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
APP P05067 1/20 0.30
KDR P35968 1/20 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
SCHEMBL6242940 0.89 BRD4 (0.32)
SCHEMBL6065066 0.86 CYP11B1 (0.34) KIF11CYP11B1CYP11B2ENPP1DRD2
SCHEMBL7078536 0.85 EDNRB (0.30)
SCHEMBL8830685 0.84 PDCD1 (0.32)
SCHEMBL3683777 0.81
SCHEMBL4556848 0.80 KIF11 (0.33) KIF11CYP11B1CYP11B2ENPP1DRD2
SCHEMBL27689410 0.78 KIF11 (0.34) KIF11CYP11B1CYP11B2ENPP1DRD2
SCHEMBL27687634 0.78 KIF11 (0.36) KIF11CYP11B1CYP11B2ENPP1DRD2
SCHEMBL2524021 0.77 ENPP1 (0.36) KIF11CYP11B1CYP11B2ENPP1DRD2
Chloromethane SCHEMBL8465733 0.77 ENPP1 (0.32) KIF11CYP11B1CYP11B2ENPP1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6664352-B1 Impregnating porous particulate support in mechanically fluidized state with catalyst material in mixer having horizontal axis counter-rotating interlocking mixing paddles BOREALIS TECHNOLOGY OY (FI) 2003-12-16 US disclosed