SCHEMBL7185587

SCHEMBL7185587

[CH2]c1c(C)cc(CC=C)c(O)c1C

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
ALOX5 P09917 2/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
GAA P10253 3/20 0.40
GABRA1 P14867 2/20 0.39
GABRB2 P47870 2/20 0.39
KDM4E B2RXH2 3/20 0.39
GLA P06280 1/20 0.35
POLB P06746 3/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSD17B10 Q99714 1/20 0.35
AKR1B1 P15121 1/20 0.34

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
SCHEMBL4557644 0.79 MEN1 (0.42) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL9348818 0.77 MEN1 (0.41) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL9332613 0.74 GAA (0.53) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL331989 0.73 GAA (0.53) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL14283804 0.73 ALOX5 (0.49) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL27976085 0.73 GABRA1 (0.50) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL1975607 0.72 GABRA1 (0.53) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL9115480 0.72 ALOX5 (0.48) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL27771899 0.72 SHBG (0.48) MEN1KMT2AALOX5PTGS1PTGS2
SCHEMBL3296445 0.71 ALOX5 (0.39) MEN1KMT2AALOX5PTGS1PTGS2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0426852-B2 USE OF A SEALED VESSEL FOR COLOURED FOOD MITSUBISHI CHEM CORP (JP) 2003-01-29 EP disclosed
EP-0426852-B1 USE OF A VESSEL FOR COLOURED FOOD MITSUBISHI CHEM CORP (JP) 1997-01-08 EP disclosed