SCHEMBL9715856

SCHEMBL9715856

C=Cc1cccc(CC[Si](Cl)(Cl)Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 3/20 0.35
TSHR P16473 1/20 0.35
PLAU P00749 1/20 0.35
FAAH O00519 1/20 0.34
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
OPRM1 P35372 2/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 2/20 0.32
TAAR1 Q96RJ0 2/20 0.32
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
KMT2A Q03164 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
SCHEMBL9715833 0.86 TP53 (0.43) TP53TDP1ALDH1A1TSHRPLAU
SCHEMBL9715858 0.86 TP53 (0.43) TP53TDP1ALDH1A1TSHRPLAU
SCHEMBL28404171 0.83 TP53 (0.39) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL29375309 0.82 TP53 (0.52) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL595016 0.82 TP53 (0.52) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL9715849 0.81 TP53 (0.44) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL1645656 0.81 TP53 (0.50) TP53TDP1ALDH1A1TSHRPLAU
SCHEMBL29619562 0.81 TP53 (0.50) TP53TDP1ALDH1A1TSHRPLAU
SCHEMBL28395002 0.80 TP53 (0.41) TP53TDP1ALDH1A1TSHRFAAH
SCHEMBL809439 0.79 TP53 (0.45) TP53TDP1ALDH1A1TSHRPLAU

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
US-5098981-A POLYORGANOSILOXANE CHISSO CORPORATION (JP) 1992-03-24 US disclosed