SCHEMBL5602252

SCHEMBL5602252

CCCCCCCCCC(C)C1CCC2=C1c1ccccc1[N]2

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR5A2 O00482 1/20 0.32
NR5A1 Q13285 1/20 0.32
SETD7 Q8WTS6 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
SCHEMBL5600852 1.00 NR5A2 (0.32) NR5A2NR5A1SETD7
SCHEMBL5600885 1.00 NR5A2 (0.32) NR5A2NR5A1SETD7
SCHEMBL5600587 1.00 NR5A2 (0.32) NR5A2NR5A1SETD7
SCHEMBL5603020 1.00 NR5A2 (0.32) NR5A2NR5A1SETD7
SCHEMBL5602886 0.99 NR5A2 (0.31) NR5A2NR5A1
SCHEMBL5600544 0.95 NR5A2 (0.30) NR5A2NR5A1
SCHEMBL5600884 0.92
SCHEMBL5601533 0.84 ACE (0.35)
SCHEMBL5602878 0.79 HTT (0.30)
SCHEMBL5604011 0.77 CYP1A2 (0.31)

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-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed