SCHEMBL7630798

SCHEMBL7630798

CCOc1cccc(C(=O)OO[C]2CC(C)CCC2C(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
HPGD P15428 3/20 0.43
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 2/20 0.41
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
NPC1 O15118 2/20 0.40
MAPT P10636 3/20 0.39
HTT P42858 2/20 0.39
POLB P06746 2/20 0.39
GAA P10253 1/20 0.39
TSHR P16473 1/20 0.39
ATM Q13315 1/20 0.39
TP53 P04637 1/20 0.38
ALOX15 P16050 1/20 0.38
ALOX12 P18054 1/20 0.38
RECQL P46063 1/20 0.38
HSD17B10 Q99714 1/20 0.38
LMNA P02545 2/20 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
SCHEMBL7627937 0.88 CHRNA1 (0.45) SMN1; SMN2ALDH1A1KMT2AMEN1TP53
SCHEMBL7629226 0.87 L3MBTL1 (0.43) RAB9ASMN1; SMN2HPGDALDH1A1KDM4E
SCHEMBL7634146 0.84 CHRNA1 (0.41) RAB9ASMN1; SMN2ALDH1A1KDM4EKMT2A
SCHEMBL7629368 0.82 NPC1 (0.47) ALDH1A1KMT2AMEN1NPC1TSHR
SCHEMBL7625857 0.82 MAPT (0.41) NPC1MAPTTP53L3MBTL1TDP1
SCHEMBL7627330 0.79 MEN1 (0.38) RAB9ASMN1; SMN2HPGDALDH1A1KDM4E
SCHEMBL7626375 0.79 MEN1 (0.36) HPGDALDH1A1KDM4EKMT2AMEN1
SCHEMBL7627283 0.79 MEN1 (0.44) HPGDALDH1A1KMT2AMEN1MAPT
SCHEMBL7634307 0.78 ALDH1A1 (0.43) RAB9AHPGDALDH1A1KDM4EKMT2A
SCHEMBL7628965 0.76 HPGD (0.47) SMN1; SMN2HPGDKMT2ANPC1MAPT

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