SCHEMBL28809673

SCHEMBL28809673

CC[Si](CC)([C]1C=Cc2ccccc21)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SETD7 Q8WTS6 3/20 0.35
ESR1 P03372 1/20 0.34
LMNA P02545 4/20 0.33
CYP1A2 P05177 3/20 0.33
CYP2D6 P10635 3/20 0.33
MEN1 O00255 3/20 0.33
KMT2A Q03164 3/20 0.33
ALOX15 P16050 2/20 0.33
TP53 P04637 2/20 0.33
CHRM2 P08172 2/20 0.33
HTR1A P08908 2/20 0.33
CHRM1 P11229 2/20 0.33
DRD2 P14416 2/20 0.33
TSHR P16473 2/20 0.33
ADRA2C P18825 2/20 0.33
CHRM3 P20309 2/20 0.33
SLC6A2 P23975 2/20 0.33
HTR2A P28223 2/20 0.33
HTR2C P28335 2/20 0.33
SLC6A4 P31645 2/20 0.33

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
SCHEMBL8080819 0.89 SETD7 (0.39) SETD7ESR1LMNACYP1A2CYP2D6
SCHEMBL27886292 0.81 SETD7 (0.34) SETD7LMNACYP1A2CYP2D6MEN1
SCHEMBL3686372 0.77 SETD7 (0.39) SETD7LMNACYP1A2CYP2D6MEN1
SCHEMBL28040820 0.76 LMNA (0.36) SETD7ESR1LMNACYP1A2CYP2D6
SCHEMBL28040402 0.76 ESR1 (0.41) SETD7ESR1LMNACYP1A2CYP2D6
SCHEMBL8071503 0.76 LMNA (0.36) SETD7ESR1LMNACYP1A2CYP2D6
SCHEMBL8079478 0.75 LMNA (0.39) SETD7LMNACYP1A2CYP2D6MEN1
SCHEMBL27886299 0.75 LMNA (0.39) SETD7LMNACYP1A2CYP2D6MEN1
SCHEMBL2444645 0.73 ESR1 (0.56) ESR1LMNATP53TSHRALDH1A1
SCHEMBL27942535 0.73 ESR1 (0.35) ESR1

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-102666607-B Olefinic polymers SUMITOMO CHEMICAL CO 2014-03-26 CN disclosed