SCHEMBL7633565

SCHEMBL7633565

Cc1cc(C)c(C(=O)OO[C]2CC(C)CCC2C(C)C)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.33
TAS1R1 Q7RTX1 4/20 0.33
TAS1R2 Q8TE23 4/20 0.33
HPGD P15428 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
MCOLN3 Q8TDD5 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP2D6 P10635 1/20 0.30
CYP2C19 P33261 1/20 0.30
HTR3E A5X5Y0 1/20 0.30
NR1I2 O75469 1/20 0.30
HTR3B O95264 1/20 0.30
HTR3A P46098 1/20 0.30
HTR3D Q70Z44 1/20 0.30
HTR3C Q8WXA8 1/20 0.30
EPHX2 P34913 1/20 0.30

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
SCHEMBL7625118 0.88 NPC1 (0.34) HPGDALDH1A1
SCHEMBL7635693 0.86 MEN1 (0.41) TAS1R3TAS1R1TAS1R2HPGDNPSR1
SCHEMBL7631523 0.84 NPC1 (0.35) TAS1R3TAS1R1TAS1R2MEN1KMT2A
SCHEMBL7630813 0.84
SCHEMBL7623601 0.82 MAPT (0.36) TAS1R3TAS1R1TAS1R2HPGDNPSR1
SCHEMBL7636551 0.81 SCN1A (0.40) MEN1KMT2AALDH1A1CYP2C19
SCHEMBL7634307 0.81 ALDH1A1 (0.43) TAS1R3TAS1R1HPGDMEN1KMT2A
SCHEMBL7634146 0.80 CHRNA1 (0.41) NPSR1KMT2AALDH1A1CYP1A2CYP2C19
SCHEMBL7632156 0.79 SMN1; SMN2 (0.38) HPGDNPSR1MEN1KMT2AALDH1A1
SCHEMBL7630710 0.78 L3MBTL1 (0.37) TAS1R3TAS1R1TAS1R2HPGDKMT2A

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