SCHEMBL9928465

SCHEMBL9928465

O=C1C=C(I)C(=O)C=C1Cl

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
ALOX12 P18054 1/20 0.42
RECQL P46063 1/20 0.42
KMT2A Q03164 1/20 0.42
TDP1 Q9NUW8 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
Benzoquinone SCHEMBL6026862 0.71 ALDH1A1 (0.68) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL4911549 0.68 MEN1 (0.47) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL8664716 0.67 MEN1 (0.48) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL10786855 0.67 MEN1 (0.42) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL21141253 0.67 MEN1 (0.42) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL7186512 0.67 MAPT (0.42) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL5160541 0.67 MEN1 (0.42) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL17033515 0.67 MEN1 (0.42) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL7195149 0.63 MEN1 (0.39) MEN1ALDH1A1MAPTHPGDALOX12
SCHEMBL1274862 0.62 MAPT (0.42) MEN1ALDH1A1MAPTHPGDALOX12

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-1196956-B1 OLIGOMERIC AND POLYMERIC OLED MATERIALS PRODUCED VIA ARYLATION OF QUINONES HONEYWELL INT INC (US) 2012-06-13 EP disclosed