SCHEMBL11745274

SCHEMBL11745274

O=C(C=C(Sc1ccccc1)Sc1ccccc1)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.62
KMT2A Q03164 3/20 0.62
NFE2L2 Q16236 1/20 0.57
ALDH1A1 P00352 7/20 0.53
MAPT P10636 6/20 0.53
LMNA P02545 4/20 0.53
NPSR1 Q6W5P4 4/20 0.53
HDAC1 Q13547 2/20 0.53
HDAC2 Q92769 2/20 0.53
PLIN1 O60240 2/20 0.53
PLIN5 Q00G26 2/20 0.53
ABHD5 Q8WTS1 2/20 0.53
HPGD P15428 1/20 0.53
HTT P42858 1/20 0.53
MAPK1 P28482 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
HDAC3 O15379 1/20 0.50
NCOR2 Q9Y618 1/20 0.50
AKT1 P31749 1/20 0.48
RECQL P46063 2/20 0.44

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
SCHEMBL13618094 0.89 MEN1 (0.76) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL29275365 0.84 NFE2L2 (0.53) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL11753006 0.82 HDAC1 (0.53) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL11753010 0.82 HDAC1 (0.53) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL31270589 0.78 MEN1 (0.51) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL11574417 0.78 MEN1 (0.51) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL5931364 0.77 MEN1 (1.00) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL4929674 0.75 NFE2L2 (0.70) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL4929667 0.75 NFE2L2 (0.70) MEN1KMT2ANFE2L2ALDH1A1MAPT
SCHEMBL3075636 0.73 NFE2L2 (0.55) MEN1KMT2ANFE2L2ALDH1A1MAPT

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-4008249-A HERBICIDE, PLANT GROWTH REGULATOR BASF AKTIENGESELLSCHAFT (DT) 1977-02-15 US disclosed