SCHEMBL28394445

SCHEMBL28394445

CCO[SiH](CCCN)CCCN

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.33
TSHR P16473 1/20 0.33
EPHX1 P07099 1/20 0.33
CYP1A2 P05177 1/20 0.33
NFKB1 P19838 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
SCHEMBL4293728 0.95 CYP1A2 (0.31) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL27586342 0.81 OPRM1 (0.31)
SCHEMBL37541 0.79 DNM1 (0.33) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL340718 0.78 TSHR (0.33) TSHR
SCHEMBL442663 0.77
Hydrochloric Acid SCHEMBL28958687 0.77 DNM1 (0.36) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL4623058 0.76 TSHR (0.37) TSHR
SCHEMBL28378589 0.75 CYP1A2 (0.31) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL7056918 0.74 TSHR (0.42) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL6057151 0.74 TSHR (0.42) DNM1MEN1KMT2AALDH1A1TSHR

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-110997314-A Composite material of metal and resin 株式会社新技术研究所 2020-04-10 CN disclosed