SCHEMBL11270274

SCHEMBL11270274

CC(C)C(C=C(Cl)Cl)C(C(=O)OC(C#N)c1cccc(Oc2cccc3ccccc23)n1)C(C)C

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
SIRT3 Q9NTG7 1/20 0.31
CARM1 Q86X55 1/20 0.30
PRMT6 Q96LA8 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
SCHEMBL11269505 0.93 SIRT2 (0.31) SIRT2SIRT1SIRT3CARM1PRMT6
SCHEMBL11274600 0.90 CARM1 (0.31) CARM1PRMT6
SCHEMBL11264917 0.87 ALDH1A1 (0.37)
SCHEMBL11274367 0.86 ALDH1A1 (0.34) SIRT2SIRT1SIRT3
SCHEMBL11283820 0.85 SCN9A (0.32)
SCHEMBL11272045 0.84 P2RX3 (0.33)
SCHEMBL11277723 0.84 CARM1 (0.31) CARM1PRMT6
SCHEMBL11271636 0.83 CARM1 (0.32) SIRT2SIRT1SIRT3CARM1PRMT6
SCHEMBL11279224 0.82 ADAMTS4 (0.33)
SCHEMBL11275520 0.81 CARM1 (0.31) CARM1PRMT6

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-4338326-A PESTICIDES UNION CARBIDE CORPORATION (US) 1982-07-06 US disclosed