SCHEMBL5601216

SCHEMBL5601216

c1ccc2c(c1)[N]C1=C2C(C2CC2)CC1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
NOS3 P29474 1/20 0.30
NOS2 P35228 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
SCHEMBL5602729 0.93 MAPT (0.36) MAPTHPGDNOS3NOS2
SCHEMBL5601130 0.93 MAPT (0.39) MAPTHPGDNOS2
SCHEMBL5600716 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5602985 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5601869 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5602448 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5600195 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5600361 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5600340 0.92 MAPT (0.38) MAPTHPGDNOS2
SCHEMBL5604114 0.77 NOS3 (0.32) NOS3NOS2

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