SCHEMBL16684672

SCHEMBL16684672

CNc1ccccc1C[SiH]1CCCCO1

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RECQL P46063 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL16684619 0.80 CYP2A13 (0.39) ALDH1A1MAPT
SCHEMBL8837414 0.76 CYP2A13 (0.39) KDM4EALDH1A1MAPT
SCHEMBL22361111 0.76 IDO1 (0.33)
SCHEMBL5016152 0.76 HSPA5 (0.39) KDM4EMAPTHSD17B10
SCHEMBL8184594 0.74
SCHEMBL2727954 0.74 SLC6A4 (0.33)
SCHEMBL11766468 0.73 IDO1 (0.39) KDM4EALDH1A1POLBRECQLNPSR1
SCHEMBL305088 0.73 ALDH1A1 (0.31) ALDH1A1
SCHEMBL22361110 0.72 GABRA1 (0.31)
SCHEMBL16499609 0.71

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-2015066138-A1 FLAME RETARDANT THERMOPLASTIC POLYMER COMPOSITIONS DOW CORNING CORPORATION (US) 2015-05-07 WO disclosed