SCHEMBL7632041

SCHEMBL7632041

[CH2]CCOOC(=O)c1ccc(OCCCC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
TP53 P04637 1/20 0.53
PLA2G4B P0C869 2/20 0.51
MAPT P10636 2/20 0.51
KMT2A Q03164 2/20 0.51
NPC1 O15118 2/20 0.49
LMNA P02545 2/20 0.49
PRSS1 P07477 1/20 0.49
ACR P10323 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
RARB P10826 3/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NFKB1 P19838 1/20 0.48
NFKB2 Q00653 1/20 0.48
RELA Q04206 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL7625725 0.96 TP53 (0.60) TSHRTP53PLA2G4BNPC1LMNA
SCHEMBL7636903 0.94 L3MBTL1 (0.53) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7636946 0.93 TSHR (0.51) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7631276 0.91 TP53 (0.54) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7630314 0.90 TP53 (0.56) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7629457 0.90 TP53 (0.56) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7628065 0.90 TP53 (0.56) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7635194 0.89 PARP10 (0.51) PLA2G4BMAPTKMT2ANPC1LMNA
SCHEMBL7635024 0.89 TSHR (0.54) TSHRTP53PLA2G4BMAPTKMT2A
SCHEMBL7635193 0.89 TP53 (0.58) TSHRTP53PLA2G4BMAPTNPC1

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