SCHEMBL5603391

SCHEMBL5603391

c1ccc2c(c1)[N]C1=C2CCCC1C1CCC1

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 3/20 0.35
NOS1 P29475 3/20 0.34
NOS3 P29474 1/20 0.34
MAPT P10636 1/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 1/20 0.30
TSHR P16473 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
SCHEMBL5602459 0.97 NOS2 (0.35) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5601548 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5600387 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5601788 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5600259 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5602159 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5603379 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5602319 0.95 NOS1 (0.36) NOS2NOS1NOS3MAPTHPGD
SCHEMBL5603618 0.95 NOS1 (0.32) NOS2NOS1NOS3
SCHEMBL5603963 0.78 HRH3 (0.35) NOS2NOS1NOS3HPGD

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