SCHEMBL7629617

SCHEMBL7629617

Cc1ccc(C(=O)OO[C]2CCC(C(C)(C)C)CC2)cc1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
ALDH1A1 P00352 5/20 0.38
HPGD P15428 2/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 5/20 0.36
NPC1 O15118 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
RAB9A P51151 2/20 0.35
CYP2D6 P10635 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
HTT P42858 2/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
POLB P06746 1/20 0.34
KDM4E B2RXH2 2/20 0.34
LMNA P02545 1/20 0.33

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
SCHEMBL7625629 0.85 KMT2A (0.47) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7632166 0.83 NPC1 (0.40) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL7625394 0.82 MEN1 (0.42) KMT2AMEN1ALDH1A1HPGDTP53
SCHEMBL7623752 0.82 CYP2D6 (0.47) KMT2AMEN1ALDH1A1MAPTNPC1
SCHEMBL7628441 0.82 KMT2A (0.46) KMT2AMEN1ALDH1A1HPGDTP53
SCHEMBL7631017 0.81 MEN1 (0.46) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7630715 0.81 TDP1 (0.49) KMT2AMEN1ALDH1A1MAPTCES2
SCHEMBL7625745 0.81 KMT2A (0.38) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7630826 0.81 MEN1 (0.38) KMT2AMEN1ALDH1A1HPGDMAPT
SCHEMBL7623552 0.80 KMT2A (0.44) KMT2AMEN1ALDH1A1HPGDTP53

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