SCHEMBL13017017

SCHEMBL13017017

CCO[Si](CCCn1ccnn1)(OCC)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 17/20 0.42
ATP4A P20648 1/20 0.38
ATP4B P51164 1/20 0.38
PADI4 Q9UM07 2/20 0.33
CYP1A1 P04798 2/20 0.33

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
SCHEMBL13017029 0.86 CYP19A1 (0.44) CYP19A1ATP4AATP4BPADI4CYP1A1
SCHEMBL16412081 0.77 TDP1 (0.35)
SCHEMBL647736 0.77 TSHR (0.33)
SCHEMBL707984 0.77 LTA4H (0.32)
SCHEMBL13017016 0.76 CYP19A1 (0.33) CYP19A1ATP4AATP4B
SCHEMBL13017009 0.76 LMNA (0.49) CYP19A1
SCHEMBL13017026 0.76 LMNA (0.48) CYP19A1
SCHEMBL21816952 0.75 ADORA2B (0.39)
SCHEMBL703455 0.74 LTA4H (0.36) CYP19A1
SCHEMBL645725 0.74 LTA4H (0.34)

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-20100330505-A1 RESIST UNDERLAYER FILM FORMING COMPOSITION CONTAINING SILICONE HAVING CYCLIC AMINO GROUP NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2010-12-30 US disclosed