SCHEMBL28010082

SCHEMBL28010082

CC(C#N)c1ccccc1CO[SiH3]

nearest known ligand 0.31

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SGMS2 Q8NHU3 5/20 0.31
ALDH1A1 P00352 3/20 0.31
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP2C9 P11712 1/20 0.30
CYP2C19 P33261 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
SCHEMBL10433853 0.80 CYP1A1 (0.34) ALDH1A1CYP1A2
SCHEMBL711281 0.80 GABRA1 (0.40) LMNACYP1A2
SCHEMBL954886 0.78 MGLL (0.41) LMNACYP1A2
SCHEMBL9496367 0.77 GABRA1 (0.44) ALDH1A1LMNAKDM4ECYP1A2
SCHEMBL28724166 0.75 TSHR (0.50) ALDH1A1KDM4E
SCHEMBL8763608 0.74 TSHR (0.42) ALDH1A1LMNACYP1A2
SCHEMBL11418603 0.74
SCHEMBL28724175 0.73 TSHR (0.34)
SCHEMBL11498091 0.72 ADRA2C (0.44) ALDH1A1LMNAKDM4ECYP1A2
SCHEMBL28901542 0.72

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103946264-B Curable epoxy composition and short curing CYTEC TECHNOLOGY CORP. (US) 2016-11-30 CN disclosed
CN-104893290-A Radiation-curable silicone composition SHINETSU CHEMICAL CO 2015-09-09 CN disclosed