SCHEMBL7632722

SCHEMBL7632722

Cc1cccc(C(=O)OO[C]2CC(C)CCC2C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.41
RAB9A P51151 5/20 0.41
MAPT P10636 4/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
KMT2A Q03164 3/20 0.39
ESR1 P03372 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
GAA P10253 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPK1 P28482 1/20 0.39
PARP1 P09874 1/20 0.39

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
SCHEMBL7634146 0.85 CHRNA1 (0.41) NPC1RAB9AMAPTHTTALDH1A1
SCHEMBL7633347 0.85 LMNA (0.46) MAPTALDH1A1LMNASMN1; SMN2KMT2A
SCHEMBL7631864 0.84 TDP1 (0.41) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL7635808 0.82 NPC1 (0.45) NPC1RAB9AMAPTALDH1A1LMNA
SCHEMBL7629906 0.81 NPC1 (0.41) NPC1RAB9AMAPTHTTALDH1A1
SCHEMBL7625790 0.80 TAS1R3 (0.38) NPC1RAB9AMAPTALDH1A1SMN1; SMN2
SCHEMBL7675141 0.79 PARP1 (0.42) NPC1RAB9AMAPTHTTALDH1A1
SCHEMBL7629538 0.79 MAPT (0.43) NPC1RAB9AMAPTHTTALDH1A1
SCHEMBL7631618 0.78 SCN1A (0.44) NPC1RAB9AMAPTLMNASMN1; SMN2
SCHEMBL7633002 0.77 MAPT (0.44) NPC1RAB9AMAPTHTTALDH1A1

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