SCHEMBL7630592

SCHEMBL7630592

COC[C](C)OOC(=O)c1ccc(OC(C)C)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
PARP10 Q53GL7 1/20 0.49
POLB P06746 1/20 0.46
MAPT P10636 5/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NPY1R P25929 1/20 0.44
NPY2R P49146 1/20 0.44
MEN1 O00255 1/20 0.40
TP53 P04637 3/20 0.40
ALDH1A1 P00352 3/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 3/20 0.39
NR1H4 Q96RI1 1/20 0.39
MTNR1A P48039 1/20 0.39
MTNR1B P49286 1/20 0.39
HPGD P15428 3/20 0.39
RAB9A P51151 2/20 0.39
ACACB O00763 1/20 0.39
ACACA Q13085 1/20 0.39

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
SCHEMBL7625317 0.85 KMT2A (0.53) KMT2APARP10POLBMAPTNPSR1
SCHEMBL7627894 0.84 CA1 (0.55) KMT2APARP10MAPTMEN1RAB9A
SCHEMBL31343186 0.84 KMT2A (0.68) KMT2APARP10POLBMAPTNPSR1
SCHEMBL7628407 0.82 SMN1; SMN2 (0.49) KMT2APOLBMAPTMEN1ALDH1A1
SCHEMBL7628557 0.81 KMT2A (0.59) KMT2APARP10POLBMAPTNPSR1
SCHEMBL7627635 0.81 ALDH1A1 (0.51) KMT2APARP10MAPTNPSR1MEN1
SCHEMBL7632802 0.80 TDP1 (0.53) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL7634780 0.78 ALDH1A1 (0.47) KMT2APOLBMAPTMEN1ALDH1A1
SCHEMBL7628440 0.78 MAPT (0.51) KMT2AMAPTTP53NPC1LMNA
SCHEMBL7627706 0.78 MAPT (0.51) KMT2AMAPTMEN1TP53THRB

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