SCHEMBL5602573

SCHEMBL5602573

FC(F)(F)c1cccc2c1N=N[N]2

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
AXL P30530 1/20 0.34
IDO1 P14902 2/20 0.32
PNMT P11086 1/20 0.32
TAAR1 Q96RJ0 2/20 0.31
PARP1 P09874 1/20 0.31
HSD11B1 P28845 1/20 0.31
KIF11 P52732 1/20 0.31
P2RX7 Q99572 1/20 0.30
CES1 P23141 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
SCHEMBL5602669 0.73
SCHEMBL792902 0.68 ALDH1A1 (0.36) ALDH1A1POLBTDP1L3MBTL1
SCHEMBL2534593 0.68 AXL (0.38) ALDH1A1POLBTDP1L3MBTL1AXL
SCHEMBL4752463 0.68 AXL (0.34) ALDH1A1POLBTDP1L3MBTL1AXL
SCHEMBL5600573 0.67 HSD11B1 (0.41) HSD11B1CES1
SCHEMBL5603289 0.65 HSD11B1 (0.36) ALDH1A1L3MBTL1AXLPARP1HSD11B1
SCHEMBL5603316 0.64 CYP1A2 (0.37) ALDH1A1POLBTDP1L3MBTL1AXL
SCHEMBL5602541 0.64 GABRA1 (0.40) L3MBTL1TAAR1
SCHEMBL15011058 0.64 AXL (0.34) ALDH1A1POLBTDP1L3MBTL1AXL
SCHEMBL5600651 0.62 HSD11B1 (0.36) ALDH1A1L3MBTL1AXLTAAR1PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed