SCHEMBL28823604

SCHEMBL28823604

Cc1ccc(O[SiH](C)C)c(N=Cc2ncccn2)c1.[H+]

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.36
ALDH1A1 P00352 6/20 0.36
KMT2A Q03164 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
GAA P10253 4/20 0.36
MEN1 O00255 3/20 0.36
USP2 O75604 1/20 0.36
MAPT P10636 7/20 0.34
HTT P42858 6/20 0.34
HSP90AA1 P07900 1/20 0.34
MAPK1 P28482 1/20 0.34
MMP14 P50281 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
LMNA P02545 3/20 0.33
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
DHODH Q02127 1/20 0.32
NFKB1 P19838 1/20 0.32
NFKB2 Q00653 1/20 0.32
RELA Q04206 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
SCHEMBL17499597 0.99 KDM4E (0.37) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL28039878 0.89 KDM4E (0.36) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL28210142 0.88 KDM4E (0.33) KDM4EMAPTHTTLMNA
SCHEMBL17499274 0.88 KDM4E (0.37) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL17499672 0.86 KDM4E (0.33) KDM4EMAPTHTTLMNA
SCHEMBL28040283 0.86 NR4A1 (0.43) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL16097217 0.84 NR4A1 (0.44) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL16096661 0.83 KDM4E (0.48) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL16096662 0.83 KDM4E (0.48) KDM4EALDH1A1KMT2ASMN1; SMN2GAA
SCHEMBL17499408 0.81 GAA (0.35) KDM4EALDH1A1KMT2ASMN1; SMN2GAA

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
CN-105209268-A Heterocyclic imine functionalized polymers BRIDGESTONE CORP 2015-12-30 CN disclosed