SCHEMBL7625936

SCHEMBL7625936

COc1ccccc1C(=O)OO[C]1CC(C)CCC1C(C)C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.43
XBP1 P17861 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ATM Q13315 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM5 P08912 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
TAS1R2 Q8TE23 1/20 0.38
HTT P42858 2/20 0.38
KDM4E B2RXH2 2/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7626136 0.90 KMT2A (0.39) MEN1KMT2ATAS1R3TAS1R1TAS1R2
SCHEMBL7627283 0.88 MEN1 (0.44) HPGDMEN1KMT2AMAPTNPSR1
SCHEMBL7630710 0.87 L3MBTL1 (0.37) HPGDKMT2ANPC1MAPTTAS1R3
SCHEMBL7632156 0.86 SMN1; SMN2 (0.38) HPGDMEN1KMT2ANPC1RAB9A
SCHEMBL7625397 0.85 ATM (0.42) HPGDXBP1MEN1KMT2AATM
SCHEMBL7631528 0.85 SCN1A (0.46) HPGDMEN1KMT2AATMNPC1
SCHEMBL7629592 0.85 KMT2A (0.38) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL7632539 0.84 ALDH1A1 (0.39) HPGDMEN1KMT2AMAPTNPSR1
SCHEMBL7629368 0.82 NPC1 (0.47) MEN1KMT2ANPC1ALDH1A1
SCHEMBL7634504 0.81 ATM (0.41) HPGDMEN1KMT2AATMNPC1

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