SCHEMBL7630880

SCHEMBL7630880

CCCOc1ccc(C(=O)OO[C]2CC(C)CCC2C(C)C)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
LMNA P02545 4/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPK1 P28482 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 5/20 0.40
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
PLK1 P53350 1/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
ACACB O00763 1/20 0.39
MEN1 O00255 2/20 0.38
TSHR P16473 2/20 0.38
TP53 P04637 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
THRB P10828 2/20 0.38

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
SCHEMBL7633621 0.96 HPGD (0.49) HPGDLMNAALDH1A1SMN1; SMN2MAPT
SCHEMBL7628965 0.93 HPGD (0.47) HPGDLMNASMN1; SMN2MAPTKMT2A
SCHEMBL7629226 0.91 L3MBTL1 (0.43) HPGDLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL7627330 0.85 MEN1 (0.38) HPGDLMNAALDH1A1KDM4ESMN1; SMN2
SCHEMBL7627495 0.85 CA1 (0.41) HPGDLMNAALDH1A1KDM4EMAPT
SCHEMBL7635771 0.84 CYP4F2 (0.36) ALDH1A1KDM4EMAPTKMT2AL3MBTL1
SCHEMBL7632747 0.84 KMT2A (0.41) HPGDALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL7636551 0.83 SCN1A (0.40) ALDH1A1SMN1; SMN2MAPTKMT2AL3MBTL1
SCHEMBL7626343 0.82 THRA (0.43) ALDH1A1MAPTKMT2AMEN1THRB
SCHEMBL7629934 0.82 POLB (0.41) LMNAALDH1A1MAPK1SMN1; SMN2MAPT

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