SCHEMBL28535968

SCHEMBL28535968

C=CC(N)([SiH3])c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 4/20 0.46
HTT P42858 1/20 0.37
TSHR P16473 4/20 0.35
ALDH1A1 P00352 3/20 0.35
TAAR1 Q96RJ0 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
KIF11 P52732 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL8854227 0.76 KCNN4 (0.46) KCNN4HTTTSHRALDH1A1CYP1A2
SCHEMBL14954722 0.75 ALDH1A1 (0.38) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL31578414 0.75 KCNN4 (0.50) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL1072785 0.75 KCNN4 (0.50) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL1286536 0.75 KCNN4 (0.50) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL2898192 0.71 KCNN4 (0.46) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL6882699 0.71 TSHR (0.46) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL1064377 0.71 TSHR (0.43) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL8634589 0.70 KCNN4 (0.44) KCNN4HTTTSHRALDH1A1TAAR1
SCHEMBL1587335 0.69 ALDH1A1 (0.41) KCNN4HTTTSHRALDH1A1TAAR1

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-107406467-B Polyvinylaminosilanes as branching agents for functionalized elastomeric polymers 盛禧奥欧洲有限责任公司 2020-11-10 CN disclosed