SCHEMBL28166287

SCHEMBL28166287

Cc1cnc(C)n1C[Si](C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.34
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
THRB P10828 1/20 0.34
TSHR P16473 1/20 0.34
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
ATM Q13315 1/20 0.33
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CHRM1 P11229 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
SCHEMBL14756121 0.78
Iodide SCHEMBL28161167 0.73 ALDH1A1 (0.36) MAPK1ALDH1A1LMNATHRBTSHR
Bromide SCHEMBL28286963 0.73 ALDH1A1 (0.36) MAPK1ALDH1A1LMNATHRBTSHR
SCHEMBL6182712 0.73 LMNA (0.36) MAPK1ALDH1A1LMNATHRBTSHR
SCHEMBL24336172 0.73 MAPK1 (0.33) MAPK1ALDH1A1LMNATHRBTSHR
SCHEMBL23204977 0.72 PDE1A (0.44) MAPK1
SCHEMBL13274470 0.71 ALDH1A1 (0.46) MAPK1ALDH1A1LMNATHRBTSHR
SCHEMBL13072243 0.71 MAPK1 (0.35) MAPK1ALDH1A1LMNATHRBTSHR
SCHEMBL23441841 0.70 KDM5A (0.36) MAPK1ALDH1A1LMNATHRBTSHR
SCHEMBL23507215 0.70 MAPK1 (0.58) MAPK1ALDH1A1LMNATHRBTSHR

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-107001976-A The method for improving the anti-coking of lubricating composition NYCO公司 2017-08-01 CN disclosed