SCHEMBL7628403

SCHEMBL7628403

CCCCCC[C](C)OOC(=O)c1ccc(CC)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HSD17B3 P37058 6/20 0.44
ALDH1A1 P00352 3/20 0.43
THRA P10827 3/20 0.43
THRB P10828 3/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
FAAH O00519 1/20 0.43
RARB P10826 4/20 0.41
MEN1 O00255 1/20 0.41
RARA P10276 1/20 0.41
MTOR P42345 1/20 0.41
KMT2A Q03164 1/20 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
SCHEMBL7633838 0.91 THRA (0.48) ALDH1A1THRATHRBMAPTFAAH
SCHEMBL7625770 0.91 THRA (0.55) ALDH1A1THRATHRBMAPTFAAH
SCHEMBL7633787 0.91 THRA (0.55) ALDH1A1THRATHRBMAPTFAAH
SCHEMBL7625706 0.91 THRA (0.51) ALDH1A1THRATHRBMAPTFAAH
SCHEMBL7625804 0.88 L3MBTL1 (0.48) HSD17B3ALDH1A1MAPTNPC1RAB9A
SCHEMBL7625349 0.86 CES2 (0.55) ALDH1A1MAPTMEN1KMT2A
SCHEMBL7627678 0.85 TP53 (0.57) THRATHRBNPC1RARB
SCHEMBL7631122 0.85 CA1 (0.47) ALDH1A1NPC1RAB9A
SCHEMBL7633506 0.84 NPC1 (0.51) ALDH1A1THRATHRBNPC1RAB9A
SCHEMBL7631376 0.84 TP53 (0.60) THRATHRBNPC1RARB

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