SCHEMBL7625865

SCHEMBL7625865

CCCCCCc1ccc(C(=O)OO[C]2CCCC(C)C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 7/20 0.44
THRB P10828 7/20 0.44
RARB P10826 4/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ALDH1A1 P00352 1/20 0.42
RARA P10276 1/20 0.42
MAPT P10636 1/20 0.42
MTOR P42345 1/20 0.42
SPHK1 Q9NYA1 7/20 0.42
SPHK2 Q9NRA0 2/20 0.41

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
SCHEMBL7633438 0.99 THRA (0.43) THRATHRBRARBMEN1KMT2A
SCHEMBL7634445 0.95 CYP4A11 (0.40) THRATHRBRARBALDH1A1MAPT
SCHEMBL7635856 0.91 PLK1 (0.38) THRBMEN1KMT2AALDH1A1MAPT
SCHEMBL7635475 0.87 MEN1 (0.42) MEN1KMT2AALDH1A1MAPT
SCHEMBL7632788 0.87 THRA (0.51) THRATHRBRARBMEN1KMT2A
SCHEMBL7630517 0.86 THRA (0.48) THRATHRBRARBMEN1KMT2A
SCHEMBL7635197 0.86 THRA (0.50) THRATHRBRARBMEN1KMT2A
SCHEMBL7631325 0.86 THRA (0.50) THRATHRBRARBMEN1KMT2A
SCHEMBL7629843 0.86 RARB (0.50) THRATHRBRARBMEN1KMT2A
SCHEMBL7633929 0.85 THRA (0.45) THRATHRBRARBMEN1KMT2A

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