SCHEMBL17499252

SCHEMBL17499252

C[Si](C)(C)Oc1ccccc1CCN=Cc1ccncc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
LMNA P02545 2/20 0.37
ABCB1 P08183 2/20 0.36
ROCK2 O75116 1/20 0.36
TAAR1 Q96RJ0 1/20 0.35
G6PC1 P35575 1/20 0.35
SHBG P04278 1/20 0.34
MAPT P10636 3/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
CA12 O43570 1/20 0.32
CA9 Q16790 1/20 0.32
NFE2L2 Q16236 1/20 0.32

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
SCHEMBL16096003 0.86 TAAR1 (0.45) CA1CA2LMNAABCB1ROCK2
SCHEMBL17499674 0.86 LMNA (0.38) CA1CA2LMNAROCK2G6PC1
SCHEMBL16103277 0.86 LMNA (0.38) CA1CA2LMNAROCK2G6PC1
SCHEMBL17499215 0.86 TAAR1 (0.42) LMNATAAR1G6PC1MAPTKDM4E
SCHEMBL17499140 0.85 SHBG (0.34) LMNATAAR1SHBGALDH1A1
SCHEMBL16097198 0.82 ABCB1 (0.36) CA1CA2ABCB1TAAR1SHBG
SCHEMBL16095976 0.82 ABCB1 (0.33) ABCB1
SCHEMBL16097342 0.82 POLB (0.39) LMNATAAR1SHBGMAPTMEN1
SCHEMBL17499624 0.81 LMNA (0.33) LMNATAAR1SHBGMAPTMEN1
SCHEMBL17499557 0.80 NR4A1 (0.39) LMNAABCB1G6PC1MAPTKDM4E

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