SCHEMBL7623943

SCHEMBL7623943

CCCOc1ccc(C(=O)OO[C]2CCCCCCCCCCC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.49
PLK1 P53350 1/20 0.49
HPGD P15428 4/20 0.48
LMNA P02545 4/20 0.48
KMT2A Q03164 4/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
HTT P42858 2/20 0.48
MAPK1 P28482 2/20 0.48
KDM4E B2RXH2 1/20 0.48
MAPT P10636 6/20 0.48
ALDH1A1 P00352 4/20 0.48
TSHR P16473 3/20 0.48
THRB P10828 2/20 0.48
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
MEN1 O00255 1/20 0.45
POLB P06746 1/20 0.44
ADRB2 P07550 1/20 0.43
ADRB1 P08588 1/20 0.43
ADRB3 P13945 1/20 0.43

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
SCHEMBL7629373 1.00 L3MBTL1 (0.49) L3MBTL1PLK1HPGDLMNAKMT2A
SCHEMBL7633947 0.99 L3MBTL1 (0.50) L3MBTL1PLK1HPGDLMNAKMT2A
SCHEMBL7633699 0.94 ALDH1A1 (0.53) HPGDLMNAKMT2ASMN1; SMN2MAPT
SCHEMBL7635340 0.94 ALDH1A1 (0.53) HPGDLMNAKMT2ASMN1; SMN2MAPT
SCHEMBL7625776 0.93 KMT2A (0.52) HPGDLMNAKMT2ASMN1; SMN2MAPT
SCHEMBL7633531 0.91 TP53 (0.56) LMNASMN1; SMN2TSHRTHRBCYP1A2
SCHEMBL7636821 0.91 TP53 (0.56) LMNASMN1; SMN2TSHRTHRBCYP1A2
SCHEMBL7634017 0.89 TP53 (0.57) LMNASMN1; SMN2TSHRTHRBCYP1A2
SCHEMBL7629980 0.89 HPGD (0.51) L3MBTL1PLK1HPGDLMNAKMT2A
SCHEMBL7634341 0.89 HPGD (0.51) L3MBTL1PLK1HPGDLMNAKMT2A

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