SCHEMBL7630715

SCHEMBL7630715

CC(C)(C)C1CC[C](OOC(=O)c2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.49
ALDH1A1 P00352 3/20 0.49
TSHR P16473 2/20 0.49
HSD17B10 Q99714 1/20 0.49
LMNA P02545 3/20 0.46
F2 P00734 1/20 0.46
CES2 O00748 1/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MAPT P10636 3/20 0.43
KDM4E B2RXH2 3/20 0.41
GLA P06280 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CHRNA7 P36544 2/20 0.40
HTR3E A5X5Y0 1/20 0.40
HTR3B O95264 1/20 0.40
HTR3A P46098 1/20 0.40
HTR3D Q70Z44 1/20 0.40
HTR3C Q8WXA8 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL7625398 0.92 MEN1 (0.44) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL7634492 0.88 TDP1 (0.44) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL7625629 0.87 KMT2A (0.47) TDP1ALDH1A1LMNACES2MEN1
SCHEMBL7631017 0.86 MEN1 (0.46) TDP1ALDH1A1HSD17B10LMNAMEN1
SCHEMBL7632166 0.85 NPC1 (0.40) ALDH1A1MEN1KMT2AMAPTKDM4E
SCHEMBL7625442 0.85 MEN1 (0.45) TDP1ALDH1A1HSD17B10LMNACES2
SCHEMBL7631319 0.85 MEN1 (0.45) TDP1ALDH1A1LMNACES2MEN1
SCHEMBL7632751 0.83 MEN1 (0.44) ALDH1A1LMNACES2MEN1KMT2A
SCHEMBL7630116 0.83 MEN1 (0.44) TDP1ALDH1A1TSHRHSD17B10LMNA
SCHEMBL7634531 0.83 LMNA (0.50) TDP1ALDH1A1TSHRHSD17B10LMNA

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