SCHEMBL7629368

SCHEMBL7629368

CC1CCC(C(C)C)[C](OOC(=O)c2ccccc2)C1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
LMNA P02545 3/20 0.41
F2 P00734 1/20 0.41
TRPM8 Q7Z2W7 2/20 0.41
CHRNA7 P36544 3/20 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
ACHE P22303 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP2D6 P10635 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
SCHEMBL7627270 0.93 PDCD1 (0.45) NPC1L3MBTL1TRPM8MEN1KMT2A
SCHEMBL7625857 0.90 MAPT (0.41) NPC1L3MBTL1TRPM8TDP1
SCHEMBL7636551 0.88 SCN1A (0.40) NPC1L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL7629934 0.87 POLB (0.41) NPC1L3MBTL1LMNAMEN1KMT2A
SCHEMBL7634146 0.87 CHRNA1 (0.41) NPC1L3MBTL1LMNAKMT2AALDH1A1
SCHEMBL7627495 0.86 CA1 (0.41) NPC1LMNATRPM8MEN1KMT2A
SCHEMBL7627330 0.86 MEN1 (0.38) NPC1L3MBTL1LMNAMEN1KMT2A
SCHEMBL7632747 0.85 KMT2A (0.41) NPC1KMT2AALDH1A1HSD17B10TDP1
SCHEMBL7633622 0.85 NPC1 (0.33) NPC1L3MBTL1
SCHEMBL7634090 0.85 TRPV1 (0.46) L3MBTL1LMNAMEN1KMT2AALDH1A1

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