SCHEMBL7629429

SCHEMBL7629429

[CH2]OOC(=O)c1ccc([Si](C=C)(CC)CC)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.35
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CHRM1 P11229 1/20 0.35
SLC6A2 P23975 1/20 0.35
KDR P35968 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
THRB P10828 6/20 0.34
LMNA P02545 5/20 0.33
CYP1A2 P05177 3/20 0.33
CYP2C19 P33261 2/20 0.33
CYP2D6 P10635 1/20 0.33
MAPK1 P28482 1/20 0.33
NR1H2 P55055 1/20 0.33
RNASEL Q05823 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 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
SCHEMBL7631723 0.87 LMNA (0.34) ESR1TSHRALDH1A1CHRM1SLC6A2
SCHEMBL7630569 0.87 LMNA (0.34) ESR1TSHRALDH1A1CHRM1SLC6A2
SCHEMBL7633168 0.85 ESR1 (0.32) ESR1TSHRALDH1A1CHRM1SLC6A2
SCHEMBL7628476 0.85 ESR1 (0.35) ESR1TSHRALDH1A1CHRM1SLC6A2
SCHEMBL7633891 0.84 LMNA (0.33) ESR1LMNACYP1A2CA12CA1
SCHEMBL7630718 0.84 LMNA (0.33) ESR1ALDH1A1LMNACYP1A2SMN1; SMN2
SCHEMBL7623473 0.83 ESR1 (0.32) ESR1TSHRALDH1A1CHRM1SLC6A2
SCHEMBL7625121 0.82 ALDH1A1 (0.32) ALDH1A1THRBLMNAF2MAPT
SCHEMBL7631467 0.82 ALDH1A1 (0.32) TSHRALDH1A1TDP1THRBTHRA
SCHEMBL7623705 0.82 ALDH1A1 (0.32) ALDH1A1MAPT

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
EP-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed