SCHEMBL7911936

SCHEMBL7911936

C=CC(O)CCC(C)CCC(O)C=C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
ALOX15 P16050 2/20 0.33
KMT2A Q03164 2/20 0.33
CYP3A4 P08684 1/20 0.33
ALDH1A1 P00352 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
BLM P54132 1/20 0.30
SLC6A3 Q01959 1/20 0.30
CYP2D6 P10635 1/20 0.30
TSHR P16473 1/20 0.30
NFKB1 P19838 1/20 0.30
CYP2C19 P33261 1/20 0.30

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
SCHEMBL4929111 0.85 SLC6A2 (0.36) MEN1KMT2ASLC6A2SLC6A4BLM
SCHEMBL11657963 0.83
SCHEMBL7329049 0.83
SCHEMBL5868379 0.83
SCHEMBL18380855 0.79
SCHEMBL15906423 0.79
SCHEMBL28929622 0.79 LMNA (0.54) MEN1ALOX15KMT2ACYP3A4BLM
SCHEMBL19843868 0.76
SCHEMBL187270 0.74
SCHEMBL6252133 0.74

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
US-6200254-B1 PRACTICAL SYNTHETIC ROUTES TO CYCLOALKADIENONES AND SATURATED AND MONO-UNSATURATED MACROCYCLIC KETONES WITH CLAISEN REARRANGEMENT OF BIS ALLYL ALCOHOLS, RING CYCLIZATION REACTION, AND SUBSEQUENT REDUCTION OR DECARBOALKOXYLATION TAKASAGO INTERNATIONAL CORPORATION (JP) 2001-03-13 US disclosed