SCHEMBL7627554

SCHEMBL7627554

CC(C)Oc1ccc(C(=O)OO[C]2CCCC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.51
PARP10 Q53GL7 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
POLB P06746 1/20 0.44
MAPT P10636 7/20 0.44
ALDH1A1 P00352 6/20 0.44
TP53 P04637 2/20 0.44
THRB P10828 1/20 0.44
HTT P42858 1/20 0.44
LMNA P02545 2/20 0.43
TSHR P16473 1/20 0.43
HSD17B10 Q99714 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
NPY1R P25929 1/20 0.42
NPY2R P49146 1/20 0.42
USP2 O75604 1/20 0.42
ALOX15 P16050 1/20 0.42

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
SCHEMBL7624270 0.98 KMT2A (0.50) KMT2APARP10SMN1; SMN2HPGDNPC1
SCHEMBL7637373 0.98 KMT2A (0.50) KMT2APARP10SMN1; SMN2HPGDNPC1
SCHEMBL7628693 0.83 CA1 (0.55) KMT2APARP10SMN1; SMN2HPGDMAPT
SCHEMBL7629987 0.83 TP53 (0.49) KMT2APARP10SMN1; SMN2HPGDNPC1
SCHEMBL31343186 0.82 KMT2A (0.68) KMT2APARP10SMN1; SMN2HPGDNPC1
SCHEMBL7630276 0.81 CA1 (0.53) KMT2APARP10SMN1; SMN2HPGDMAPT
SCHEMBL7631441 0.81 ALDH1A1 (0.44) KMT2ASMN1; SMN2HPGDNPC1RAB9A
SCHEMBL7633045 0.81 CA1 (0.53) KMT2APARP10SMN1; SMN2HPGDMAPT
SCHEMBL7631117 0.80 ALDH1A1 (0.43) KMT2ASMN1; SMN2HPGDNPC1RAB9A
SCHEMBL7631459 0.80 ALDH1A1 (0.43) KMT2ASMN1; SMN2HPGDNPC1RAB9A

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