SCHEMBL7634090

SCHEMBL7634090

CC1CCC(C(C)C)[C](OOC(=O)c2ccc(C(C)(C)C)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 3/20 0.46
TP53 P04637 1/20 0.41
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HDAC1 Q13547 1/20 0.36
PRSS1 P07477 1/20 0.35
ACR P10323 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
GAA P10253 1/20 0.34
BCHE P06276 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL7636551 0.86 SCN1A (0.40) TP53MEN1KMT2AMAPTTDP1
SCHEMBL7629934 0.85 POLB (0.41) TRPV1MEN1KMT2AMAPTL3MBTL1
SCHEMBL7627365 0.85 TP53 (0.41) TRPV1TP53MEN1KMT2AMAPT
SCHEMBL7629368 0.85 NPC1 (0.47) MEN1KMT2ATDP1L3MBTL1ALDH1A1
SCHEMBL7627330 0.84 MEN1 (0.38) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL7627495 0.84 CA1 (0.41) TRPV1MEN1KMT2AMAPTALDH1A1
SCHEMBL7633622 0.83 NPC1 (0.33) L3MBTL1
SCHEMBL7632747 0.83 KMT2A (0.41) TP53KMT2AMAPTTDP1ALDH1A1
SCHEMBL7627270 0.83 PDCD1 (0.45) TRPV1TP53MEN1KMT2AMAPT
SCHEMBL7629226 0.81 L3MBTL1 (0.43) TP53MEN1KMT2AMAPTL3MBTL1

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