SCHEMBL7633947

SCHEMBL7633947

CCCOc1ccc(C(=O)OO[C]2CCCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 4/20 0.50
PLK1 P53350 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.49
MAPK1 P28482 2/20 0.49
MAPT P10636 6/20 0.47
LMNA P02545 4/20 0.47
HTT P42858 2/20 0.47
KMT2A Q03164 4/20 0.46
HPGD P15428 4/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 4/20 0.46
TSHR P16473 3/20 0.46
THRB P10828 2/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C19 P33261 1/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.45
ADRB2 P07550 1/20 0.44
ADRB1 P08588 1/20 0.44
ADRB3 P13945 1/20 0.44

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 0.99 L3MBTL1 (0.49) L3MBTL1PLK1SMN1; SMN2MAPK1MAPT
SCHEMBL7623943 0.99 L3MBTL1 (0.49) L3MBTL1PLK1SMN1; SMN2MAPK1MAPT
SCHEMBL7625776 0.94 KMT2A (0.52) SMN1; SMN2MAPTLMNAKMT2AHPGD
SCHEMBL7633699 0.93 ALDH1A1 (0.53) SMN1; SMN2MAPTLMNAKMT2AHPGD
SCHEMBL7635340 0.93 ALDH1A1 (0.53) SMN1; SMN2MAPTLMNAKMT2AHPGD
SCHEMBL7634017 0.91 TP53 (0.57) SMN1; SMN2LMNATSHRTHRBCYP1A2
SCHEMBL7633531 0.89 TP53 (0.56) SMN1; SMN2LMNATSHRTHRBCYP1A2
SCHEMBL7636821 0.89 TP53 (0.56) SMN1; SMN2LMNATSHRTHRBCYP1A2
SCHEMBL7630489 0.88 HPGD (0.50) L3MBTL1PLK1MAPTLMNAKMT2A
SCHEMBL7629980 0.87 HPGD (0.51) L3MBTL1PLK1MAPTLMNAHTT

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