SCHEMBL7625901

SCHEMBL7625901

Cc1cc(C)c(C(=O)OO[C]2CCCCCCCCCCC2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 4/20 0.41
TAS1R1 Q7RTX1 4/20 0.41
TAS1R2 Q8TE23 4/20 0.41
KMT2A Q03164 3/20 0.38
CYP3A4 P08684 4/20 0.34
ACHE P22303 1/20 0.34
POLB P06746 2/20 0.33
EPHX2 P34913 1/20 0.33
PRNP P04156 1/20 0.33
PPARG P37231 1/20 0.33
HTT P42858 1/20 0.33
NCOA2 Q15596 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
NR2E3 Q9Y5X4 1/20 0.33
NCOR2 Q9Y618 1/20 0.33
GLO1 Q04760 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33

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
SCHEMBL7631354 1.00 TAS1R3 (0.41) TAS1R3TAS1R1TAS1R2KMT2ACYP3A4
SCHEMBL7626702 0.98 TAS1R3 (0.38) TAS1R3TAS1R1TAS1R2KMT2ACYP3A4
SCHEMBL7628494 0.83 CA12 (0.36) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL7634202 0.83 CA12 (0.36) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL7631014 0.81 HPGD (0.42) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL7625771 0.81 CA12 (0.37) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL7633040 0.81 HPGD (0.42) TAS1R3TAS1R1TAS1R2KMT2APOLB
SCHEMBL7627040 0.80 NPC1 (0.40) KMT2APOLBKDM4ESMN1; SMN2MEN1
SCHEMBL7633624 0.80 NPC1 (0.40) KMT2APOLBKDM4ESMN1; SMN2MEN1
SCHEMBL7623494 0.79 MEN1 (0.42) TAS1R3TAS1R1TAS1R2KMT2APOLB

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