SCHEMBL5602856

SCHEMBL5602856

CCc1ccc2c(c1CC)[N]c1ccccc1-2

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CSNK2A2 P19784 1/20 0.31
CSNK2B P67870 1/20 0.31
CSNK2A1 P68400 1/20 0.31
CSNK2A3 Q8NEV1 1/20 0.31
CYP2D6 P10635 1/20 0.31

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
SCHEMBL5601789 0.82 NOS3 (0.34) LMNANPC1ALDH1A1MAPTMAPK1
SCHEMBL5600247 0.81 GABRA1 (0.39) LMNANPC1ALDH1A1MAPTMAPK1
SCHEMBL5603052 0.81 KDM4E (0.35) ALDH1A1
SCHEMBL5602936 0.79 ELANE (0.35) CYP2D6
SCHEMBL5603548 0.78 GPR3 (0.38) MAPT
SCHEMBL5600551 0.77 GPR3 (0.40) ALDH1A1MAPT
SCHEMBL5600733 0.75 NOS2 (0.37) ALDH1A1
SCHEMBL5602034 0.75 MAOA (0.36) MAPTMAPK1CYP2D6
SCHEMBL5602143 0.73 HSD11B1 (0.32) ALDH1A1MAPT
SCHEMBL5601844 0.72 GPR3 (0.35) L3MBTL1

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