SCHEMBL17499530

SCHEMBL17499530

Cn1cnc(C=Nc2ccccc2O[Si](C)(C)C)c1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.33
KDM4E B2RXH2 3/20 0.33
HSD17B10 Q99714 2/20 0.33
CASP1 P29466 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
HPGD P15428 2/20 0.32
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
SENP7 Q9BQF6 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
SCHEMBL17499525 1.00 ALDH1A1 (0.33) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499679 0.86 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499676 0.86 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10CASP1RXFP1
SCHEMBL17499761 0.84 AMY1A (0.31)
SCHEMBL17499759 0.84 AMY1A (0.31)
SCHEMBL17499511 0.83 LRRK2 (0.32) KDM4EMEN1KMT2AHTT
SCHEMBL17499506 0.83 LRRK2 (0.32) KDM4EMEN1KMT2AHTT
SCHEMBL17499405 0.82 MEN1 (0.31) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL17499403 0.82 MEN1 (0.31) ALDH1A1KDM4EMEN1KMT2A
SCHEMBL17499273 0.81 ALDH1A1 (0.30) ALDH1A1HPGD

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2969593-B1 POLYMERS FUNCTIONALIZED WITH HETEROCYCLIC IMINES BRIDGESTONE CORP (JP) 2020-11-04 EP disclosed
US-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed