SCHEMBL7635572

SCHEMBL7635572

[CH2]CCCOOC(=O)c1c(C)cc(C)cc1C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.33
SMN1; SMN2 Q16637 4/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 3/20 0.33
LMNA P02545 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 2/20 0.32
CYP3A4 P08684 1/20 0.32
ELANE P08246 1/20 0.32
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
CRHR1 P34998 1/20 0.31
ITGB1 P05556 1/20 0.30
ITGA4 P13612 1/20 0.30
TAS1R3 Q7RTX0 2/20 0.30
TAS1R1 Q7RTX1 2/20 0.30
TAS1R2 Q8TE23 2/20 0.30
TSHR P16473 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
SCHEMBL7632319 0.95 ALDH1A1 (0.33) ALDH1A1SMN1; SMN2L3MBTL1KDM4ELMNA
SCHEMBL7623498 0.94 ESR1 (0.33) ALDH1A1SMN1; SMN2L3MBTL1KDM4ELMNA
SCHEMBL7636601 0.94 ESR1 (0.33) ALDH1A1SMN1; SMN2L3MBTL1KDM4ELMNA
SCHEMBL7634305 0.94 ESR1 (0.33) ALDH1A1SMN1; SMN2L3MBTL1KDM4ELMNA
SCHEMBL7625958 0.90 L3MBTL1 (0.35) ALDH1A1SMN1; SMN2L3MBTL1KDM4ELMNA
SCHEMBL7634384 0.84 CA12 (0.35) SMN1; SMN2L3MBTL1MEN1HPGDKMT2A
SCHEMBL7624983 0.83 L3MBTL1 (0.36) ALDH1A1SMN1; SMN2L3MBTL1KDM4ELMNA
SCHEMBL7628457 0.82 CNR2 (0.38) L3MBTL1MEN1KMT2ATDP1
SCHEMBL7623290 0.80 KMT2A (0.41) SMN1; SMN2MEN1KMT2AMAPTTAS1R3
SCHEMBL7631327 0.80

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