SCHEMBL17499196

SCHEMBL17499196

C[SiH](C)Oc1ccccc1N=Cc1cncnc1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
GAA P10253 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CYP1B1 Q16678 1/20 0.31
CHAT P28329 1/20 0.30
MEN1 O00255 1/20 0.30
USP2 O75604 1/20 0.30
KMT2A Q03164 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL17499625 0.86 ALDH1A1 (0.46) ALDH1A1HSD17B10GAAL3MBTL1MEN1
SCHEMBL17499147 0.84 DHFR (0.38) KDM4EALDH1A1HSD17B10GAAL3MBTL1
SCHEMBL16096903 0.83 ALDH1A1 (0.46) KDM4EALDH1A1CASP1HSD17B10RXFP1
SCHEMBL16096904 0.83 ALDH1A1 (0.46) KDM4EALDH1A1CASP1HSD17B10RXFP1
SCHEMBL17499342 0.81 CYP1B1 (0.34) KDM4EALDH1A1CASP1HSD17B10RXFP1
SCHEMBL17499345 0.81 CYP1B1 (0.34) KDM4EALDH1A1CASP1HSD17B10RXFP1
SCHEMBL17499722 0.79 KDM4E (0.30) KDM4EALDH1A1CASP1HSD17B10RXFP1
SCHEMBL17499110 0.79
SCHEMBL16098151 0.77 GRIN1 (0.33) ALDH1A1GAAMEN1KMT2ASMN1; SMN2
SCHEMBL17499534 0.77 POLB (0.40) GAACYP1B1KMT2A

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