SCHEMBL7094489

SCHEMBL7094489

CC(C)(C)[Si](C)(C)Oc1ccc(C(C#N)N(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
PREP P48147 3/20 0.34
ALDH1A1 P00352 3/20 0.33
CA12 O43570 4/20 0.33
CA1 P00915 4/20 0.33
CA9 Q16790 4/20 0.33
POLB P06746 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.32
PBRM1 Q86U86 1/20 0.31
TRPA1 O75762 1/20 0.30
ATM Q13315 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL7090240 0.76 SLC6A2 (0.38) PREPCA12CA1CA9
SCHEMBL7090238 0.74 TRPM8 (0.36) PREPCA12CA1CA9NPSR1
SCHEMBL7093358 0.74 LMNA (0.50) LMNAALDH1A1POLBGAATRPA1
SCHEMBL9480558 0.73 PREP (0.40) LMNAPREPALDH1A1CA12CA1
SCHEMBL9700930 0.73 PREP (0.40) PREPALDH1A1CA12CA1CA9
SCHEMBL24294037 0.73 PREP (0.36) PREPCA12CA1CA9
SCHEMBL24294202 0.72 PREP (0.35) PREPCA12CA1CA9
SCHEMBL2368966 0.72 PREP (0.45) PREPALDH1A1CA12CA1CA9
SCHEMBL17480107 0.71 PREP (0.44) PREPALDH1A1CA12CA1CA9
SCHEMBL6763899 0.70 PREP (0.53) PREPALDH1A1CA12CA1CA9

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
WO-2003082777-A2 NOVEL GLUCOCORTICOID RECEPTOR LIGANDS KARO BIO AB (SE) 2003-10-09 WO disclosed