SCHEMBL7630895

SCHEMBL7630895

CCCCCCc1ccc(C(=O)OO[C]2CCC(C(C)(C)C)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
THRA P10827 13/20 0.46
THRB P10828 13/20 0.46
HAO1 Q9UJM8 1/20 0.43
RARB P10826 4/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
ALDH1A1 P00352 1/20 0.43
RARA P10276 1/20 0.43
MAPT P10636 1/20 0.43
MTOR P42345 1/20 0.43
FAAH O00519 1/20 0.42

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
SCHEMBL7633563 0.99 THRA (0.44) THRATHRBHAO1RARBMEN1
SCHEMBL7625406 0.95 MEN1 (0.41) THRATHRBRARBMEN1KMT2A
SCHEMBL7626018 0.91 KMT2A (0.43) THRBMEN1KMT2AALDH1A1MAPT
SCHEMBL7625897 0.87 THRA (0.46) THRATHRBRARBMEN1KMT2A
SCHEMBL7630517 0.87 THRA (0.48) THRATHRBRARBMEN1KMT2A
SCHEMBL7631319 0.87 MEN1 (0.45) MEN1KMT2AALDH1A1MAPT
SCHEMBL7628075 0.86 THRA (0.47) THRATHRBRARBMEN1KMT2A
SCHEMBL7624315 0.86 THRA (0.44) THRATHRBRARBMEN1KMT2A
SCHEMBL7629657 0.86 THRA (0.46) THRATHRBRARBMEN1KMT2A
SCHEMBL7632788 0.85 THRA (0.51) 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