SCHEMBL17499307

SCHEMBL17499307

Cc1cccc(O[Si](C)(C)C)c1N=CCc1cn(C)cn1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
MTOR P42345 1/20 0.33
HRH4 Q9H3N8 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 2/20 0.31
MAPK1 P28482 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 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
SCHEMBL16098119 0.88 CYP2C9 (0.34) TSHRCYP2C9CYP2C19MTORHRH4
SCHEMBL16101727 0.85 CYP2C9 (0.32) TSHRCYP2C9CYP2C19MTORHRH4
SCHEMBL17499192 0.83 CYP2C9 (0.33) TSHRCYP2C9CYP2C19MTORHRH4
SCHEMBL17499099 0.83 CYP2C9 (0.34) TSHRCYP2C9CYP2C19MTORHRH4
SCHEMBL16097814 0.81 SYK (0.39)
SCHEMBL17499276 0.81 ALDH1A1 (0.30) TSHRLMNAMAPK1ALDH1A1HPGD
SCHEMBL17499273 0.81 ALDH1A1 (0.30) TSHRLMNAMAPK1ALDH1A1HPGD
SCHEMBL16096699 0.79 KDM4E (0.32) TSHRLMNAMAPK1ALDH1A1HPGD
SCHEMBL17499542 0.79 CYP2C9 (0.33) TSHRCYP2C9CYP2C19MTORHRH4
SCHEMBL16097834 0.79 NOTUM (0.33) TSHRLMNAMAPK1ALDH1A1HPGD

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